smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H](C[N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl)C(=O)[O-]	ZINC000054333835	551168878	/nfs/dbraw/zinc/16/88/78/551168878.db2.gz	WCNWZMIVHQPUCW-YFKPBYRVSA-N	-2	1	391.070	2.755	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)C(=O)[O-]	ZINC000262573906	553172272	/nfs/dbraw/zinc/17/22/72/553172272.db2.gz	ZQRGOMBMEJURQP-SNVBAGLBSA-N	-2	1	388.642	2.629	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2c(Cl)cc(F)cc2Br)CCC1	ZINC000282804969	563425901	/nfs/dbraw/zinc/42/59/01/563425901.db2.gz	KKFWIFZJEFBOKU-UHFFFAOYSA-N	-2	1	386.626	2.527	20	0		GFADML
Cc1cc(C)c(C(=O)[O-])c([N-]S(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)c1	ZINC000410386710	563589285	/nfs/dbraw/zinc/58/92/85/563589285.db2.gz	XQAZGCPDWINCOS-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C(NCc1nccs1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436566000	563674362	/nfs/dbraw/zinc/67/43/62/563674362.db2.gz	SSZOZQHVXWPYQX-UHFFFAOYSA-N	-2	1	395.487	2.641	20	0		GFADML
CCC[C@@H]([N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)C(=O)[O-]	ZINC000471990456	564209898	/nfs/dbraw/zinc/20/98/98/564209898.db2.gz	XSPJFSZSSZOOCD-SECBINFHSA-N	-2	1	388.642	2.773	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(Cl)c1	ZINC000509590938	564305273	/nfs/dbraw/zinc/30/52/73/564305273.db2.gz	OBVPNTGBDJNQTL-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1cc2c(cc1C)OCO2	ZINC000479249076	564432963	/nfs/dbraw/zinc/43/29/63/564432963.db2.gz	RATFKCGIWPJEQE-UHFFFAOYSA-N	-2	1	381.431	2.945	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)Nc1ccc(C(=O)[O-])cc1O	ZINC000479431852	564439631	/nfs/dbraw/zinc/43/96/31/564439631.db2.gz	YUKLFRKJHOBOHD-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
O=C([O-])[C@@H](Cc1cccc(Cl)c1)[N-]S(=O)(=O)c1ccc(F)c(F)c1F	ZINC000547931937	564522819	/nfs/dbraw/zinc/52/28/19/564522819.db2.gz	OVVWTPSGTKCORR-LLVKDONJSA-N	-2	1	393.770	2.732	20	0		GFADML
O=C([O-])[C@@H](Cc1cccc(Cl)c1)[N-]S(=O)(=O)c1cccc(F)c1F	ZINC000547936841	564523917	/nfs/dbraw/zinc/52/39/17/564523917.db2.gz	SULDVWYZZVLTBK-GFCCVEGCSA-N	-2	1	375.780	2.592	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(CC(=O)[O-])cc2)cc1Cl	ZINC000548196620	564534913	/nfs/dbraw/zinc/53/49/13/564534913.db2.gz	CXRSUSJHOMLNDS-UHFFFAOYSA-N	-2	1	382.825	2.726	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl)C(=O)[O-]	ZINC000548209266	564536927	/nfs/dbraw/zinc/53/69/27/564536927.db2.gz	FKNGPYMGIYSCLH-QMMMGPOBSA-N	-2	1	391.070	2.897	20	0		GFADML
O=C([O-])[C@@H](O)[C@@H](CC1CCCCC1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000549549335	564597794	/nfs/dbraw/zinc/59/77/94/564597794.db2.gz	RGGPVSKRXBMOFJ-KGLIPLIRSA-N	-2	1	393.864	2.542	20	0		GFADML
O=C([O-])[C@H](CC(F)F)[N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F	ZINC000551996418	564671929	/nfs/dbraw/zinc/67/19/29/564671929.db2.gz	NRRSHUUTFRNVNQ-ZETCQYMHSA-N	-2	1	381.706	2.746	20	0		GFADML
O=C(NC[C@@H]1CCCS1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000531560897	564913564	/nfs/dbraw/zinc/91/35/64/564913564.db2.gz	PRHYZUYYJFAKMR-LBPRGKRZSA-N	-2	1	398.531	2.880	20	0		GFADML
C[C@@H](C(=O)[O-])C1([N-]S(=O)(=O)c2cc(Br)sc2Cl)CC1	ZINC000650427847	565819908	/nfs/dbraw/zinc/81/99/08/565819908.db2.gz	SYCLARQTPNDRDL-YFKPBYRVSA-N	-2	1	388.692	2.696	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1sccc1Br)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653494181	565969603	/nfs/dbraw/zinc/96/96/03/565969603.db2.gz	SPAKIRJFUIQBRU-HRDYMLBCSA-N	-2	1	396.328	2.924	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cc(F)c(F)c(F)c2)ccc1OCC(=O)[O-]	ZINC000607331441	565983098	/nfs/dbraw/zinc/98/30/98/565983098.db2.gz	ITFDDBANEXZOJB-UHFFFAOYSA-N	-2	1	375.324	2.677	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C[S@@](C)=O)c1	ZINC000609658311	566047823	/nfs/dbraw/zinc/04/78/23/566047823.db2.gz	IBEHVUNORDUKTO-XMMPIXPASA-N	-2	1	385.438	2.512	20	0		GFADML
COc1cc(Cl)ccc1S(=O)(=O)Nc1ccc(C(=O)[O-])c(C(=O)[O-])c1	ZINC000681557066	566110990	/nfs/dbraw/zinc/11/09/90/566110990.db2.gz	MJAUGGBZCWRJLL-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)NCCCC(=O)[O-])ccc2C)cc1	ZINC000485551610	597277841	/nfs/dbraw/zinc/27/78/41/597277841.db2.gz	UGSQBDGEDLWGQR-UHFFFAOYSA-N	-2	1	390.461	2.699	20	0		GFADML
O=C([O-])CCCCNC(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1[O-]	ZINC000739667588	599741728	/nfs/dbraw/zinc/74/17/28/599741728.db2.gz	KVGDZWDEYXVMCT-KRWDZBQOSA-N	-2	1	384.432	2.521	20	0		GFADML
O=C([O-])CSCCC(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000739851872	599746772	/nfs/dbraw/zinc/74/67/72/599746772.db2.gz	HGSZIXHPUGRSLW-UHFFFAOYSA-N	-2	1	394.474	2.634	20	0		GFADML
CCOCc1cccc([N-]S(=O)(=O)c2cc(C(=O)OC)ccc2C(=O)[O-])c1	ZINC000737177332	599815636	/nfs/dbraw/zinc/81/56/36/599815636.db2.gz	FRCIWVXAJQNLJO-UHFFFAOYSA-N	-2	1	393.417	2.509	20	0		GFADML
Cc1ccc(C(=O)NC2CC2)cc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000268651381	599905772	/nfs/dbraw/zinc/90/57/72/599905772.db2.gz	UTZAOCRCMHKDDH-UHFFFAOYSA-N	-2	1	388.445	2.695	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2cccc(-c3n[nH]c(C4CC4)n3)c2)c1	ZINC000588630806	599926700	/nfs/dbraw/zinc/92/67/00/599926700.db2.gz	WYJNKTSWXPYFST-UHFFFAOYSA-N	-2	1	384.417	2.848	20	0		GFADML
CC(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736396687	599952764	/nfs/dbraw/zinc/95/27/64/599952764.db2.gz	WJJZQTVSTFKZJH-ZWKOTPCHSA-N	-2	1	385.464	2.737	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(NC(=O)[C@@H]3C[C@@H]3C(=O)[O-])ccc2C)c1	ZINC000262592753	600102941	/nfs/dbraw/zinc/10/29/41/600102941.db2.gz	IEJYVPXGIYOTGZ-CVEARBPZSA-N	-2	1	388.445	2.763	20	0		GFADML
O=C([O-])C1(NC(=O)COC(=O)c2ccc(Cl)c(Cl)c2[O-])CCCCC1	ZINC000739324214	600109764	/nfs/dbraw/zinc/10/97/64/600109764.db2.gz	HNDPJQGHQNYRSZ-UHFFFAOYSA-N	-2	1	390.219	2.760	20	0		GFADML
Cc1cccc(C(C)(C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000738693673	600198782	/nfs/dbraw/zinc/19/87/82/600198782.db2.gz	YHCJGJWGXOXGOE-UHFFFAOYSA-N	-2	1	393.443	2.766	20	0		GFADML
O=C([O-])c1sccc1S(=O)(=O)[N-]c1ccc(O[C@@H]2CCCC[C@@H]2O)cc1	ZINC000740291320	600245573	/nfs/dbraw/zinc/24/55/73/600245573.db2.gz	ZSZYZAPWDFKZQV-UONOGXRCSA-N	-2	1	397.474	2.929	20	0		GFADML
CC(C)COc1ccc([N-]S(=O)(=O)c2ccc(OCCC(=O)[O-])cc2)cn1	ZINC000736447658	600254062	/nfs/dbraw/zinc/25/40/62/600254062.db2.gz	DQVIMDCIHFPCCW-UHFFFAOYSA-N	-2	1	394.449	2.771	20	0		GFADML
Cc1c(C[S@](C)=O)cccc1[N-]S(=O)(=O)c1cc(F)ccc1C(=O)[O-]	ZINC000738290642	600254864	/nfs/dbraw/zinc/25/48/64/600254864.db2.gz	UBSYCOCOGJANSK-DEOSSOPVSA-N	-2	1	385.438	2.512	20	0		GFADML
CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)cc1	ZINC000736846511	600300186	/nfs/dbraw/zinc/30/01/86/600300186.db2.gz	FONHFHCKWKKYMV-UHFFFAOYSA-N	-2	1	391.449	2.946	20	0		GFADML
COC(=O)N(C)Cc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000737631795	600300341	/nfs/dbraw/zinc/30/03/41/600300341.db2.gz	QMQZMIOUUGXINN-UHFFFAOYSA-N	-2	1	396.396	2.523	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(OCC(C)C)nc2)cc1C(=O)[O-]	ZINC000604856450	600545382	/nfs/dbraw/zinc/54/53/82/600545382.db2.gz	QXVZJILXIWHLIL-UHFFFAOYSA-N	-2	1	380.422	2.624	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3cccc(NC(=O)[O-])c3)cc21	ZINC000736134771	600634658	/nfs/dbraw/zinc/63/46/58/600634658.db2.gz	OYJFKMQWUOHQDO-UHFFFAOYSA-N	-2	1	389.433	2.876	20	0		GFADML
CC(=O)N(Cc1ccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])cc1)C1CC1	ZINC000736129973	600635827	/nfs/dbraw/zinc/63/58/27/600635827.db2.gz	HHRDYIAUHLTPTI-UHFFFAOYSA-N	-2	1	388.445	2.697	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)ccc1C(=O)[O-]	ZINC000831327716	600687927	/nfs/dbraw/zinc/68/79/27/600687927.db2.gz	LSXJAHDEQDAQBU-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CC(C)(CC(=O)[O-])NC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(F)cc2)c1	ZINC000736311052	600789049	/nfs/dbraw/zinc/78/90/49/600789049.db2.gz	GLTVZVJOZPBQRD-UHFFFAOYSA-N	-2	1	394.424	2.610	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)cc(OC)c1OC	ZINC000506552178	600885427	/nfs/dbraw/zinc/88/54/27/600885427.db2.gz	CFVKXIJGLLHSBI-UHFFFAOYSA-N	-2	1	381.406	2.520	20	0		GFADML
Cn1cnnc1-c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000739057902	600889678	/nfs/dbraw/zinc/88/96/78/600889678.db2.gz	NJGUTWFARNSKSD-UHFFFAOYSA-N	-2	1	392.824	2.635	20	0		GFADML
CCC(CC)(NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1)C(=O)[O-]	ZINC000571360147	600921703	/nfs/dbraw/zinc/92/17/03/600921703.db2.gz	QFWZNYMDZZYDCB-UHFFFAOYSA-N	-2	1	390.461	2.861	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)cc1	ZINC000736123496	601046793	/nfs/dbraw/zinc/04/67/93/601046793.db2.gz	LABVGWMDMAVMIJ-UHFFFAOYSA-N	-2	1	381.385	2.699	20	0		GFADML
Cc1nc(C2([N-]S(=O)(=O)c3cc(C(=O)[O-])c(C)o3)CCCCCC2)no1	ZINC000578745460	601215990	/nfs/dbraw/zinc/21/59/90/601215990.db2.gz	VNUKMTKVRSZMST-UHFFFAOYSA-N	-2	1	383.426	2.506	20	0		GFADML
CCc1cc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])c(Cl)cc2Cl)on1	ZINC000761289531	601250407	/nfs/dbraw/zinc/25/04/07/601250407.db2.gz	ULZRYGJNYYFNDI-UHFFFAOYSA-N	-2	1	379.221	2.721	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)[O-])ccc1F	ZINC000776434675	601319493	/nfs/dbraw/zinc/31/94/93/601319493.db2.gz	JCYLGIICMJAOFO-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COC(=O)C=Cc1ccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)cc1	ZINC000831123763	601328755	/nfs/dbraw/zinc/32/87/55/601328755.db2.gz	DQOWVFFNMMESEZ-RUDMXATFSA-N	-2	1	394.380	2.903	20	0		GFADML
O=C([O-])c1c[nH]c2cc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)ccc12	ZINC000732047463	601331242	/nfs/dbraw/zinc/33/12/42/601331242.db2.gz	OLCTZBQATHJYII-UHFFFAOYSA-N	-3	1	378.337	2.504	20	0		GFADML
Cc1nnc(-c2ccc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)cc2)o1	ZINC000738379208	601332700	/nfs/dbraw/zinc/33/27/00/601332700.db2.gz	PPSHBJYDLUEFGY-UHFFFAOYSA-N	-2	1	377.353	2.683	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cs1)c1nc(C2CCCCC2)no1	ZINC000827747962	601384977	/nfs/dbraw/zinc/38/49/77/601384977.db2.gz	XHFFHYPPLKVFFU-SECBINFHSA-N	-2	1	385.467	2.917	20	0		GFADML
Cc1cc(C)c(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c(C)c1	ZINC000832874461	601450438	/nfs/dbraw/zinc/45/04/38/601450438.db2.gz	KWVONUOEAUUHFQ-UHFFFAOYSA-N	-2	1	379.416	2.970	20	0		GFADML
Cc1ccc2ncccc2c1S(=O)(=O)[N-]c1ccc2[nH]nc(C(=O)[O-])c2c1	ZINC000832960293	601475149	/nfs/dbraw/zinc/47/51/49/601475149.db2.gz	QDZOZCSCNUYPQD-UHFFFAOYSA-N	-2	1	382.401	2.919	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cccc3c2CCCC3)ccc1C(=O)[O-]	ZINC000831327373	601475448	/nfs/dbraw/zinc/47/54/48/601475448.db2.gz	JNZNEBQRUROGOP-UHFFFAOYSA-N	-2	1	389.429	2.851	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1Cl	ZINC000825907821	601856350	/nfs/dbraw/zinc/85/63/50/601856350.db2.gz	FZNYBWSLNGZYLE-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
O=C([O-])Cc1cccc(NC(=O)c2cc(I)ccc2[O-])c1	ZINC000236431334	602143303	/nfs/dbraw/zinc/14/33/03/602143303.db2.gz	AEDARNYJLKZZJW-UHFFFAOYSA-N	-2	1	397.168	2.876	20	0		GFADML
CCOC(=O)c1cccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])c1	ZINC000739477655	602243811	/nfs/dbraw/zinc/24/38/11/602243811.db2.gz	GZNJBOSRQVVBKE-UHFFFAOYSA-N	-2	1	390.417	2.705	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]c2cc(NC(=O)[O-])ccc2F)cc1OC	ZINC000739867826	602654802	/nfs/dbraw/zinc/65/48/02/602654802.db2.gz	VGQZXRVRUWWDPH-UHFFFAOYSA-N	-2	1	388.348	2.873	20	0		GFADML
CN(Cc1cccc([N-]S(=O)(=O)c2ccc3c(c2)OCCCO3)c1)C(=O)[O-]	ZINC000739712780	602655130	/nfs/dbraw/zinc/65/51/30/602655130.db2.gz	LMGWSYLZKXVUFJ-UHFFFAOYSA-N	-2	1	392.433	2.759	20	0		GFADML
C[C@@H]1CCCN(C(=O)C2CCN(C(=O)c3ccc(NC(=O)[O-])cc3[O-])CC2)C1	ZINC000739102869	602849224	/nfs/dbraw/zinc/84/92/24/602849224.db2.gz	INDZBFYURNLHNE-CYBMUJFWSA-N	-2	1	389.452	2.593	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCc3c(cnn3-c3ccccc3)C2)c([O-])c1	ZINC000740698426	602850039	/nfs/dbraw/zinc/85/00/39/602850039.db2.gz	KZWVMPCIMYWLMV-UHFFFAOYSA-N	-2	1	378.388	2.866	20	0		GFADML
C[C@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1ccc(N2CCOC2=O)cc1	ZINC000739026018	602854050	/nfs/dbraw/zinc/85/40/50/602854050.db2.gz	WFWQJLHWSOMVPB-NSHDSACASA-N	-2	1	385.376	2.930	20	0		GFADML
Cc1ccc(NC(=O)C[C@@H](C)NC(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1	ZINC000830364050	603330274	/nfs/dbraw/zinc/33/02/74/603330274.db2.gz	LVUHBBQIHJMMBA-CYBMUJFWSA-N	-2	1	391.449	2.781	20	0		GFADML
C[C@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2cccc(C(=O)N(C)C)c2)cc1	ZINC000825449766	603400339	/nfs/dbraw/zinc/40/03/39/603400339.db2.gz	YPYNEYGLJUOJKK-LBPRGKRZSA-N	-2	1	391.449	2.518	20	0		GFADML
O=C([O-])NCc1n[nH]c(-c2ccc(NC(=O)c3ccc([O-])c(Cl)c3)cc2)n1	ZINC000832730217	603913207	/nfs/dbraw/zinc/91/32/07/603913207.db2.gz	OFBWXMRZVZHCSG-UHFFFAOYSA-N	-2	1	387.783	2.851	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc([C@@H](C)NC(=O)[O-])cc1	ZINC000829855391	604314577	/nfs/dbraw/zinc/31/45/77/604314577.db2.gz	UITNRQZLJFACID-LLVKDONJSA-N	-3	1	378.406	2.823	20	0		GFADML
CC(C)(CCC(=O)[O-])NC(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1[O-]	ZINC000833456975	604709335	/nfs/dbraw/zinc/70/93/35/604709335.db2.gz	FRTJDRNSDORGAT-UHFFFAOYSA-N	-2	1	392.330	2.876	20	0		GFADML
Cc1nnc(-c2cccc([N-]S(=O)(=O)c3cccc(C)c3C(=O)[O-])c2)n1C	ZINC000832972645	604793070	/nfs/dbraw/zinc/79/30/70/604793070.db2.gz	ITJNWUJKUWSRDY-UHFFFAOYSA-N	-2	1	386.433	2.598	20	0		GFADML
C[C@@]1([N-]S(=O)(=O)c2sccc2Br)CCCC[C@H]1C(=O)[O-]	ZINC000833572482	604808332	/nfs/dbraw/zinc/80/83/32/604808332.db2.gz	SXSRQIKOCLVTII-QPUJVOFHSA-N	-2	1	382.301	2.822	20	0		GFADML
C[C@]1([N-]S(=O)(=O)c2sccc2Br)CCCC[C@H]1C(=O)[O-]	ZINC000833572484	604808453	/nfs/dbraw/zinc/80/84/53/604808453.db2.gz	SXSRQIKOCLVTII-UFBFGSQYSA-N	-2	1	382.301	2.822	20	0		GFADML
CC(C)C[C@@H](C)Oc1cc(C[N-]S(=O)(=O)c2csnc2C(=O)[O-])ccn1	ZINC000833475251	605026804	/nfs/dbraw/zinc/02/68/04/605026804.db2.gz	PKPMKDJOHWWZJU-LLVKDONJSA-N	-2	1	399.494	2.528	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)cc1C(=O)[O-]	ZINC000753775420	605166937	/nfs/dbraw/zinc/16/69/37/605166937.db2.gz	VFKFGNMYTUKOCY-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C(=O)[O-])cc1CO	ZINC000833662617	605168576	/nfs/dbraw/zinc/16/85/76/605168576.db2.gz	IEMUWKKHCQNVNF-UHFFFAOYSA-N	-2	1	385.825	2.730	20	0		GFADML
O=C([O-])Nc1ccc(CC[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)cc1	ZINC000834258956	605402577	/nfs/dbraw/zinc/40/25/77/605402577.db2.gz	OSCKPLHGRZLISN-UHFFFAOYSA-N	-2	1	390.248	2.999	20	0		GFADML
Cc1cc(Br)c([O-])c(NC(=O)CO[C@H]2CCCN(C(=O)[O-])C2)c1	ZINC000833898912	605472250	/nfs/dbraw/zinc/47/22/50/605472250.db2.gz	WWVFNYZOYVSOCN-JTQLQIEISA-N	-2	1	387.230	2.561	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCCC[C@@H]2c2nnc3n2CCCC3)c([O-])c1	ZINC000834254166	605655050	/nfs/dbraw/zinc/65/50/50/605655050.db2.gz	AKNTYKRGAHGSGD-CQSZACIVSA-N	-2	1	385.424	2.777	20	0		GFADML
O=C([O-])NCCOc1ccc([N-]S(=O)(=O)c2ccc(F)cc2Cl)cc1	ZINC000834244584	606081004	/nfs/dbraw/zinc/08/10/04/606081004.db2.gz	ATRGTHZLSAHEND-UHFFFAOYSA-N	-2	1	388.804	2.926	20	0		GFADML
COCC[C@H](C)Sc1nc(-c2ccc(OC)cc2)c(-c2nnn[n-]2)c(=O)[n-]1	ZINC000821685660	606704859	/nfs/dbraw/zinc/70/48/59/606704859.db2.gz	LWRHWLJWKNXGNK-JTQLQIEISA-N	-2	1	388.453	2.555	20	0		GFADML
CCCCCC[C@](C)([N-]S(=O)(=O)c1cn(C)nc1C(F)(F)F)C(=O)[O-]	ZINC000829982906	660628331	/nfs/dbraw/zinc/62/83/31/660628331.db2.gz	IRHICRKERVYZIJ-ZDUSSCGKSA-N	-2	1	385.408	2.531	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])ccc1F	ZINC000747615578	655780610	/nfs/dbraw/zinc/78/06/10/655780610.db2.gz	ARNZEWGFROAGHN-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(N3CCC3=O)cc2)ccc1Cl	ZINC000799126572	659166679	/nfs/dbraw/zinc/16/66/79/659166679.db2.gz	GDJOKHHZVRIQFR-UHFFFAOYSA-N	-2	1	380.809	2.576	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCC(F)CC1	ZINC000881609837	662998256	/nfs/dbraw/zinc/99/82/56/662998256.db2.gz	JRHIRMXPEYEPLG-UHFFFAOYSA-N	-2	1	384.454	2.829	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1F)CCS2	ZINC000899949092	663703695	/nfs/dbraw/zinc/70/36/95/663703695.db2.gz	LLIMWSOCGXECIN-UQACVICXSA-N	-2	1	393.889	2.886	20	0		GFADML
O=S(=O)([N-]c1ccn(CC(F)F)n1)c1c([O-])cccc1OC(F)(F)F	ZINC000901894916	663749772	/nfs/dbraw/zinc/74/97/72/663749772.db2.gz	DEGFSPLBSDRFEN-UHFFFAOYSA-N	-2	1	387.286	2.553	20	0		GFADML
CC(C)(CC[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000424397212	563378157	/nfs/dbraw/zinc/37/81/57/563378157.db2.gz	ZCFKPWQPXUXWMC-UHFFFAOYSA-N	-2	1	390.708	2.943	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2ccsc2)ccc1N1CCSCC1	ZINC000285317085	563514662	/nfs/dbraw/zinc/51/46/62/563514662.db2.gz	ZMYGOBSWLQEQCK-UHFFFAOYSA-N	-2	1	384.504	2.800	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1Cl	ZINC000477424039	564377036	/nfs/dbraw/zinc/37/70/36/564377036.db2.gz	OQNDLDMSQNRUGO-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1csnc1C(=O)[O-])c1nc(C(C)(C)C)cs1	ZINC000567797871	564389095	/nfs/dbraw/zinc/38/90/95/564389095.db2.gz	CQLXACFRYMPZAB-ZETCQYMHSA-N	-2	1	375.497	2.635	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)c1c(F)cccc1F	ZINC000547615005	564503195	/nfs/dbraw/zinc/50/31/95/564503195.db2.gz	JXTTVVJDEAOWJC-GFCCVEGCSA-N	-2	1	379.743	2.862	20	0		GFADML
CC(C)[C@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000516902280	564515800	/nfs/dbraw/zinc/51/58/00/564515800.db2.gz	JBIRZAYQWSMZEH-JTQLQIEISA-N	-2	1	386.214	2.505	20	0		GFADML
COc1nc2ccc([N-]S(=O)(=O)c3cc(F)cc(C(=O)[O-])c3)cc2s1	ZINC000551473229	564651012	/nfs/dbraw/zinc/65/10/12/564651012.db2.gz	JSLVZOJBYUUIET-UHFFFAOYSA-N	-2	1	382.394	2.943	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2cc(Cl)c(Br)cc2F)CCC1	ZINC000554539088	564764551	/nfs/dbraw/zinc/76/45/51/564764551.db2.gz	DUWPBEUTVHGKIO-UHFFFAOYSA-N	-2	1	386.626	2.527	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2cc(F)cc(Cl)c2)cc2c1OCCO2	ZINC000535890576	565023877	/nfs/dbraw/zinc/02/38/77/565023877.db2.gz	AAYRJYGJXHUBBP-UHFFFAOYSA-N	-2	1	387.772	2.749	20	0		GFADML
C[C@H](Sc1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCO3)cc1)C(=O)[O-]	ZINC000504666715	565042890	/nfs/dbraw/zinc/04/28/90/565042890.db2.gz	XWQWSMLWWLQWQA-JTQLQIEISA-N	-2	1	381.431	2.781	20	0		GFADML
C[C@@H](Sc1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCO3)cc1)C(=O)[O-]	ZINC000504666716	565042933	/nfs/dbraw/zinc/04/29/33/565042933.db2.gz	XWQWSMLWWLQWQA-SNVBAGLBSA-N	-2	1	381.431	2.781	20	0		GFADML
O=C([O-])C1(C[N-]S(=O)(=O)c2sc3ccccc3c2Cl)CCOCC1	ZINC000562966571	565049939	/nfs/dbraw/zinc/04/99/39/565049939.db2.gz	FRYZTDQZCDXYQO-UHFFFAOYSA-N	-2	1	389.882	2.714	20	0		GFADML
O=C([O-])c1ccc(CS(=O)(=O)[N-]c2cc(Br)ccc2O)cc1	ZINC000647923811	565683260	/nfs/dbraw/zinc/68/32/60/565683260.db2.gz	RVYUIEKRCXMDPD-UHFFFAOYSA-N	-2	1	386.223	2.795	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C[S@](C)=O)c1	ZINC000609658270	566047552	/nfs/dbraw/zinc/04/75/52/566047552.db2.gz	CRBYPLMANDDHCN-DEOSSOPVSA-N	-2	1	381.475	2.627	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)c1	ZINC000609985419	566060233	/nfs/dbraw/zinc/06/02/33/566060233.db2.gz	JURXVTZOWIRZAJ-UHFFFAOYSA-N	-2	1	383.447	2.661	20	0		GFADML
COc1ccc(NC(=O)Nc2ccc(C(=O)[O-])c(C)c2)cc1[N-]S(C)(=O)=O	ZINC000820846064	597474013	/nfs/dbraw/zinc/47/40/13/597474013.db2.gz	PTFHYUWXEXTTNW-UHFFFAOYSA-N	-2	1	393.421	2.717	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cccc(C(=O)NCCCCC(=O)[O-])c2)c1	ZINC000262362394	598165214	/nfs/dbraw/zinc/16/52/14/598165214.db2.gz	KNIQSZHBFFANAN-UHFFFAOYSA-N	-2	1	390.461	2.781	20	0		GFADML
O=C([O-])[C@@H](CNC(=O)c1ccc(Br)cc1[O-])Cc1ccc(O)cc1	ZINC000739396841	599718211	/nfs/dbraw/zinc/71/82/11/599718211.db2.gz	KDYVNLJOGKUNOM-LLVKDONJSA-N	-2	1	394.221	2.534	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(OC)cc2C(=O)[O-])cc1	ZINC000737030038	599765553	/nfs/dbraw/zinc/76/55/53/599765553.db2.gz	OPOMUYWAKJQPEC-UHFFFAOYSA-N	-2	1	393.417	2.761	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)ccc1F	ZINC000737154363	599853544	/nfs/dbraw/zinc/85/35/44/599853544.db2.gz	RNOUGMWGLGTIML-UHFFFAOYSA-N	-2	1	395.408	2.820	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2cc(Br)c(F)cc2F)CCCCC1	ZINC000739519732	599981872	/nfs/dbraw/zinc/98/18/72/599981872.db2.gz	MEAYNTJOUACWNE-UHFFFAOYSA-N	-2	1	398.225	2.793	20	0		GFADML
CSCc1ccc(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)cc1	ZINC000738194864	600124911	/nfs/dbraw/zinc/12/49/11/600124911.db2.gz	JSYHEIOYPUSJLY-UHFFFAOYSA-N	-2	1	397.456	2.908	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1c(C(=O)[O-])ccc2cccnc21	ZINC000738546363	600170055	/nfs/dbraw/zinc/17/00/55/600170055.db2.gz	VXKNUHRQJQEFGM-UHFFFAOYSA-N	-2	1	386.385	2.740	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCCC[C@@H]3c3ccco3)cc2)[n-]1	ZINC000739877063	600214427	/nfs/dbraw/zinc/21/44/27/600214427.db2.gz	JGOSRTOBIODITE-QGZVFWFLSA-N	-2	1	395.415	2.753	20	0		GFADML
CSc1nc(C)c(CCC(=O)Nc2ccc(CN(C)C(=O)[O-])cc2)c(=O)[n-]1	ZINC000738211156	600284785	/nfs/dbraw/zinc/28/47/85/600284785.db2.gz	SHUCAPPHRAFKPI-UHFFFAOYSA-N	-2	1	390.465	2.894	20	0		GFADML
CN(Cc1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCCCO3)cc1)C(=O)[O-]	ZINC000737485740	600299111	/nfs/dbraw/zinc/29/91/11/600299111.db2.gz	DHUAMWQPUKWGQO-UHFFFAOYSA-N	-2	1	392.433	2.759	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CN(C)C(=O)[O-])cc1	ZINC000738993024	600299797	/nfs/dbraw/zinc/29/97/97/600299797.db2.gz	KKKSNLFGUZKWBT-UHFFFAOYSA-N	-3	1	384.435	2.665	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)O[C@H](C(=O)[O-])c1cccc(Cl)c1	ZINC000738873600	600329862	/nfs/dbraw/zinc/32/98/62/600329862.db2.gz	XTOJSECDDIIEKH-KRWDZBQOSA-N	-2	1	389.795	2.617	20	0		GFADML
CC[C@@H](C)[C@H]1CCCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736880130	600409546	/nfs/dbraw/zinc/40/95/46/600409546.db2.gz	LMZFRJVXDMLORG-RDTXWAMCSA-N	-2	1	385.464	2.834	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3ccc(F)c(C(=O)[O-])c3)cc21	ZINC000364749293	600633745	/nfs/dbraw/zinc/63/37/45/600633745.db2.gz	TVUSRCBNTUDMMJ-UHFFFAOYSA-N	-2	1	392.408	2.624	20	0		GFADML
Cc1cc(C(=O)Nc2cc3ccccc3cc2C(=O)[O-])[nH]c2nc(=O)[n-]c(=O)c1-2	ZINC000738335170	600679127	/nfs/dbraw/zinc/67/91/27/600679127.db2.gz	CLJMPCHKUFJJCD-UHFFFAOYSA-N	-2	1	390.355	2.848	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)ccc1C	ZINC000831348529	600814976	/nfs/dbraw/zinc/81/49/76/600814976.db2.gz	ZBZROJLPQPQQLV-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(-c3nnc4n3CCC4)cc2)ccc1C(=O)[O-]	ZINC000738477090	600888371	/nfs/dbraw/zinc/88/83/71/600888371.db2.gz	KQVMWOVPJNOYIP-UHFFFAOYSA-N	-2	1	398.444	2.699	20	0		GFADML
CCCNC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737029750	600889523	/nfs/dbraw/zinc/88/95/23/600889523.db2.gz	MEHAETDUHILPEF-UHFFFAOYSA-N	-2	1	396.852	2.979	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])c(F)cc2F)c1F	ZINC000832868066	601224481	/nfs/dbraw/zinc/22/44/81/601224481.db2.gz	AWDJXGQYAXYHDJ-UHFFFAOYSA-N	-3	1	389.307	2.610	20	0		GFADML
CC(C)C(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000031669208	601320884	/nfs/dbraw/zinc/32/08/84/601320884.db2.gz	RMZCBGDELLBCJX-UHFFFAOYSA-N	-2	1	380.397	2.919	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(OC[C@@H]3CCCO3)c2)ccc1F	ZINC000044857832	601321628	/nfs/dbraw/zinc/32/16/28/601321628.db2.gz	IJOKVQZZFXBZHM-AWEZNQCLSA-N	-2	1	395.408	2.883	20	0		GFADML
COc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)[O-])cc(C)c1C	ZINC000608005226	601333368	/nfs/dbraw/zinc/33/33/68/601333368.db2.gz	UQIRZFUXUFRXEY-UHFFFAOYSA-N	-2	1	379.390	2.509	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)ccc1C	ZINC000831328764	601334503	/nfs/dbraw/zinc/33/45/03/601334503.db2.gz	YBBFPXWHFPOPNC-UXBLZVDNSA-N	-2	1	375.402	2.680	20	0		GFADML
C/C(=C\COC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(C)c2)c1)C(=O)[O-]	ZINC000825781055	601405769	/nfs/dbraw/zinc/40/57/69/601405769.db2.gz	OMKKHIWZRWLMKI-NTEUORMPSA-N	-2	1	389.429	2.984	20	0		GFADML
C/C(=C/COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)cc2)cc1)C(=O)[O-]	ZINC000825780845	601413474	/nfs/dbraw/zinc/41/34/74/601413474.db2.gz	JPEGZMDSSRVDLR-KAMYIIQDSA-N	-2	1	389.429	2.984	20	0		GFADML
CC[C@@](C)(CC(=O)[O-])NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1	ZINC000767052591	601471596	/nfs/dbraw/zinc/47/15/96/601471596.db2.gz	ZXIMBWSQNJKONT-IBGZPJMESA-N	-2	1	390.461	2.861	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)CCC(=O)N3)ccc1Cl	ZINC000032087602	601827435	/nfs/dbraw/zinc/82/74/35/601827435.db2.gz	JTLHINPVZOCYNP-UHFFFAOYSA-N	-2	1	380.809	2.724	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1C(=O)N(C)C	ZINC000751216025	601830093	/nfs/dbraw/zinc/83/00/93/601830093.db2.gz	CONSHONDJCZYAV-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
CC1(C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(CCC(=O)[O-])cc3)cc21	ZINC000828046408	601840889	/nfs/dbraw/zinc/84/08/89/601840889.db2.gz	WPQBRRXDGKBIGI-UHFFFAOYSA-N	-2	1	388.445	2.734	20	0		GFADML
COC(=O)Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000763300025	601987745	/nfs/dbraw/zinc/98/77/45/601987745.db2.gz	QQAGHCDWSJBAKP-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCN3C(=O)[O-])cc1	ZINC000739791422	602646078	/nfs/dbraw/zinc/64/60/78/602646078.db2.gz	HYGDJQWIWOJTNN-UHFFFAOYSA-N	-2	1	390.417	2.705	20	0		GFADML
COc1ccc(-c2nsc([N-]C(=O)c3csc(CNC(=O)[O-])n3)n2)cc1	ZINC000739882914	602703632	/nfs/dbraw/zinc/70/36/32/602703632.db2.gz	KZLMJLQOIICCDS-UHFFFAOYSA-N	-2	1	391.434	2.690	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2cc(Cl)c3c(c2)OCCO3)c([O-])c1	ZINC000740697931	602847856	/nfs/dbraw/zinc/84/78/56/602847856.db2.gz	MAYCIXUARNWCBF-UHFFFAOYSA-N	-2	1	378.768	2.837	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NC2CCN(C(=O)[O-])CC2)c([O-])c1	ZINC000736283771	602849812	/nfs/dbraw/zinc/84/98/12/602849812.db2.gz	PVYOQPZBYWIOIS-UHFFFAOYSA-N	-2	1	379.413	2.611	20	0		GFADML
COc1ccccc1N1CCC(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000739976292	602856998	/nfs/dbraw/zinc/85/69/98/602856998.db2.gz	MBLWZGLGJWLQKS-UHFFFAOYSA-N	-2	1	385.420	2.890	20	0		GFADML
COc1cccc(N2CC[C@@H](CNC(=O)c3ccc(NC(=O)[O-])cc3[O-])C2)c1	ZINC000739951656	602858794	/nfs/dbraw/zinc/85/87/94/602858794.db2.gz	UNTKPUKZXZJCQG-ZDUSSCGKSA-N	-2	1	385.420	2.747	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)c([O-])c1	ZINC000740699718	602859501	/nfs/dbraw/zinc/85/95/01/602859501.db2.gz	XNBJLBNRNYLBNJ-MRXNPFEDSA-N	-2	1	378.331	2.974	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)c([O-])c1	ZINC000740697749	602863948	/nfs/dbraw/zinc/86/39/48/602863948.db2.gz	HWXYKBNOHBISBJ-LBPRGKRZSA-N	-2	1	377.347	2.769	20	0		GFADML
CC(C)[C@@H](C[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)NC(=O)[O-]	ZINC000738792468	603084601	/nfs/dbraw/zinc/08/46/01/603084601.db2.gz	HDLIGVZXLHVXFL-SNVBAGLBSA-N	-2	1	388.795	2.929	20	0		GFADML
COCc1cccc(S(=O)(=O)[N-]c2cccc3c2CCN(C(=O)[O-])C3)c1	ZINC000739846390	603182851	/nfs/dbraw/zinc/18/28/51/603182851.db2.gz	NOMDCXWPVVBVCN-UHFFFAOYSA-N	-2	1	376.434	2.670	20	0		GFADML
O=C([O-])NCCOc1cccc([N-]S(=O)(=O)c2cccc3ncccc32)c1	ZINC000832672518	603399597	/nfs/dbraw/zinc/39/95/97/603399597.db2.gz	RELFCWDTTSYMLP-UHFFFAOYSA-N	-2	1	387.417	2.682	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@H](CNC(=O)[O-])C1CCCCC1	ZINC000830704361	603490212	/nfs/dbraw/zinc/49/02/12/603490212.db2.gz	MZZQFQSQKVPZML-CYBMUJFWSA-N	-2	1	378.473	2.734	20	0		GFADML
C[C@H](CN(C)C(=O)[O-])C(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000824880908	604095660	/nfs/dbraw/zinc/09/56/60/604095660.db2.gz	POSVUOCIYZYXMM-CYBMUJFWSA-N	-2	1	391.449	2.672	20	0		GFADML
O=C([O-])c1ccc(Cl)c(S(=O)(=O)[N-]c2cccnc2Br)c1	ZINC000236488571	604403344	/nfs/dbraw/zinc/40/33/44/604403344.db2.gz	IFPRRHMUYLCBMH-UHFFFAOYSA-N	-2	1	391.630	2.997	20	0		GFADML
CC(C)COC[C@@H]([N-]S(=O)(=O)c1ccc(F)cc1C(=O)[O-])c1ccco1	ZINC000833487751	604685368	/nfs/dbraw/zinc/68/53/68/604685368.db2.gz	HGQUSSQQRKEODS-CQSZACIVSA-N	-2	1	385.413	2.809	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cs2)c(Br)n1	ZINC000832953043	604798476	/nfs/dbraw/zinc/79/84/76/604798476.db2.gz	ZWASBNLJAGGUFH-UHFFFAOYSA-N	-2	1	377.241	2.713	20	0		GFADML
O=C([O-])C[C@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C1CC1	ZINC000776577213	604810408	/nfs/dbraw/zinc/81/04/08/604810408.db2.gz	JHRDTNPVRTYJCD-LURJTMIESA-N	-2	1	388.692	2.696	20	0		GFADML
CC(=O)Nc1c(C)ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)c1C	ZINC000674050123	605160528	/nfs/dbraw/zinc/16/05/28/605160528.db2.gz	GDXCDBJBODVIBY-UHFFFAOYSA-N	-2	1	380.397	2.900	20	0		GFADML
COc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(C)c2Cl)c(C(=O)[O-])c1	ZINC000758163046	605166903	/nfs/dbraw/zinc/16/69/03/605166903.db2.gz	KVYDQJUDCRPNDN-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)c1	ZINC000829216730	605236207	/nfs/dbraw/zinc/23/62/07/605236207.db2.gz	AVFVABLPSGJYCR-UHFFFAOYSA-N	-2	1	380.422	2.614	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)c([O-])c1	ZINC000834255304	605600290	/nfs/dbraw/zinc/60/02/90/605600290.db2.gz	HTXWFKZVCKHSQW-UHFFFAOYSA-N	-2	1	390.359	2.863	20	0		GFADML
C[C@@]1(C(=O)[O-])CCCC[C@@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000135572830	655021089	/nfs/dbraw/zinc/02/10/89/655021089.db2.gz	XGVXLWSJTXNLEG-JOYOIKCWSA-N	-2	1	382.301	2.822	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]c2cc3c(cc2Cl)OCO3)c1	ZINC000328212235	655386891	/nfs/dbraw/zinc/38/68/91/655386891.db2.gz	SKHAMQZEBAWKCF-UHFFFAOYSA-N	-2	1	391.735	2.846	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)CCc1scnc1C	ZINC000578135482	655473277	/nfs/dbraw/zinc/47/32/77/655473277.db2.gz	GUABMKFCYQWLCD-UHFFFAOYSA-N	-2	1	384.479	2.923	20	0		GFADML
Cc1c(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)cccc1C(=O)[O-]	ZINC000728266787	655554103	/nfs/dbraw/zinc/55/41/03/655554103.db2.gz	ZMNHUWHCYGEKBH-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
CC(F)(F)CC[N-]S(=O)(=O)c1sc(C(=O)[O-])cc1Br	ZINC000840891465	661199992	/nfs/dbraw/zinc/19/99/92/661199992.db2.gz	PMDLDAKKBFAWTE-UHFFFAOYSA-N	-2	1	378.216	2.532	20	0		GFADML
COC(=O)CCc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)c1	ZINC000786100634	657407073	/nfs/dbraw/zinc/40/70/73/657407073.db2.gz	KSOPVSAIHLLEOV-UHFFFAOYSA-N	-2	1	383.447	2.661	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-][C@H](C)CCCCC(=O)[O-])c(F)cc1Cl	ZINC000794762855	658609995	/nfs/dbraw/zinc/60/99/95/658609995.db2.gz	PVNHKFFBEYUINE-SECBINFHSA-N	-2	1	395.836	2.578	20	0		GFADML
C[C@@H]1CC(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)C[C@@H](C)O1	ZINC000802722535	659495639	/nfs/dbraw/zinc/49/56/39/659495639.db2.gz	BESZIMXWIMFWDV-NXEZZACHSA-N	-2	1	377.409	2.535	20	0		GFADML
COc1cc(S(=O)(=O)[N-][C@@H](C2CC2)C(F)(F)F)c(Cl)cc1C(=O)[O-]	ZINC000871962940	662746891	/nfs/dbraw/zinc/74/68/91/662746891.db2.gz	JDQQYUXKWUPIBD-NSHDSACASA-N	-2	1	387.763	2.666	20	0		GFADML
COc1ccc(Cl)cc1NS(=O)(=O)c1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000054795443	551170249	/nfs/dbraw/zinc/17/02/49/551170249.db2.gz	LXNGXGOUWOSNLM-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
Cc1oc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Br)cc1F	ZINC000055311227	551172746	/nfs/dbraw/zinc/17/27/46/551172746.db2.gz	HCINLXRHYFVDEF-UHFFFAOYSA-N	-2	1	378.175	2.989	20	0		GFADML
CS(=O)(=O)[N-]c1ccccc1[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000125495069	551321934	/nfs/dbraw/zinc/32/19/34/551321934.db2.gz	PQODYBCJEKJUNR-UHFFFAOYSA-N	-2	1	378.834	2.651	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)ccc1Cl	ZINC000326786686	563455747	/nfs/dbraw/zinc/45/57/47/563455747.db2.gz	QALZNWCYGBHQRT-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)cc1CO	ZINC000327737777	563459353	/nfs/dbraw/zinc/45/93/53/563459353.db2.gz	XAKHFMCCSCFVST-UHFFFAOYSA-N	-2	1	385.825	2.730	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCC(=O)N3)cc1Cl	ZINC000327974346	563459900	/nfs/dbraw/zinc/45/99/00/563459900.db2.gz	YLNSBFUBUNMPQA-UHFFFAOYSA-N	-2	1	380.809	2.724	20	0		GFADML
CN(C)C(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000393124354	563528514	/nfs/dbraw/zinc/52/85/14/563528514.db2.gz	PLESRVSGLWZDMO-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)c(C(=O)[O-])cc1C	ZINC000410396367	563589205	/nfs/dbraw/zinc/58/92/05/563589205.db2.gz	GSBPQNHSFYRPRH-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1c(Br)cccc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(O)c1	ZINC000436650857	563676272	/nfs/dbraw/zinc/67/62/72/563676272.db2.gz	XVJKRACWBHJZQB-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc(-c3nc[nH]n3)c2)cc1Cl	ZINC000365676007	563790755	/nfs/dbraw/zinc/79/07/55/563790755.db2.gz	CXLHVYUCNCMWSZ-UHFFFAOYSA-N	-2	1	378.797	2.624	20	0		GFADML
O=C([O-])c1cccc(CC[N-]S(=O)(=O)c2cc(Cl)sc2Cl)n1	ZINC000541929530	564295561	/nfs/dbraw/zinc/29/55/61/564295561.db2.gz	ZVQQOGOUPIYGBH-UHFFFAOYSA-N	-2	1	381.262	2.669	20	0		GFADML
O=C(NC[C@@H]1CC12CC2)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000565881802	564300914	/nfs/dbraw/zinc/30/09/14/564300914.db2.gz	SOLOKDSNHLMAAU-NSHDSACASA-N	-2	1	378.475	2.784	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(F)cc(Cl)c2)cc2c1OCCO2	ZINC000477432316	564377088	/nfs/dbraw/zinc/37/70/88/564377088.db2.gz	SXXMYSCXPPBJNI-UHFFFAOYSA-N	-2	1	387.772	2.749	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])cc1C(=O)[O-]	ZINC000479294141	564434416	/nfs/dbraw/zinc/43/44/16/564434416.db2.gz	HSBXGRPQALIGNJ-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1C[S@](C)=O	ZINC000547241987	564480441	/nfs/dbraw/zinc/48/04/41/564480441.db2.gz	CGGMJXRTNIQVCB-DEOSSOPVSA-N	-2	1	385.438	2.512	20	0		GFADML
Cc1oc(S(=O)(=O)[N-]C[C@H](c2ccccc2)C(F)(F)F)cc1C(=O)[O-]	ZINC000515643403	564485052	/nfs/dbraw/zinc/48/50/52/564485052.db2.gz	QJNQKAVHWWUUDZ-GFCCVEGCSA-N	-2	1	377.340	2.911	20	0		GFADML
CC(C)=CCSC[C@H]([N-]S(=O)(=O)c1ccc(F)c(F)c1F)C(=O)[O-]	ZINC000547613984	564503296	/nfs/dbraw/zinc/50/32/96/564503296.db2.gz	DCDZACOVVZBDIZ-JTQLQIEISA-N	-2	1	383.413	2.535	20	0		GFADML
O=C([O-])CCCCC[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000547789712	564510403	/nfs/dbraw/zinc/51/04/03/564510403.db2.gz	YHPOJFNEUALPAO-UHFFFAOYSA-N	-2	1	386.214	2.651	20	0		GFADML
COc1cc(C)c([N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)c(C(=O)[O-])c1	ZINC000548264791	564545627	/nfs/dbraw/zinc/54/56/27/564545627.db2.gz	WLLSRNPUDBVEKB-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1ccc(Br)o1)c1ccccc1	ZINC000548266842	564546326	/nfs/dbraw/zinc/54/63/26/564546326.db2.gz	IYLGUMPPPVJERU-NSHDSACASA-N	-2	1	388.239	2.579	20	0		GFADML
O=C([O-])[C@H](O)[C@H](CC1CCCCC1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000549549336	564597501	/nfs/dbraw/zinc/59/75/01/564597501.db2.gz	RGGPVSKRXBMOFJ-UONOGXRCSA-N	-2	1	393.864	2.542	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)cc1	ZINC000520625487	564609171	/nfs/dbraw/zinc/60/91/71/564609171.db2.gz	KOHUBMZEKUPQCZ-UHFFFAOYSA-N	-2	1	383.447	2.661	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])co1)c1nc(C(F)(F)F)cs1	ZINC000577218605	564729940	/nfs/dbraw/zinc/72/99/40/564729940.db2.gz	FNJOYLIMTKCIBP-SSDOTTSWSA-N	-2	1	384.357	2.883	20	0		GFADML
O=C([O-])[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cc(Br)sc2Cl)C1	ZINC000582893685	564866284	/nfs/dbraw/zinc/86/62/84/564866284.db2.gz	NMOUDKFLBCZKGF-RITPCOANSA-N	-2	1	388.692	2.696	20	0		GFADML
COCc1ccccc1[N-]S(=O)(=O)c1ccc(OCC(=O)[O-])c(Cl)c1	ZINC000500365941	564951121	/nfs/dbraw/zinc/95/11/21/564951121.db2.gz	PFOCVXNEPYWPTL-UHFFFAOYSA-N	-2	1	385.825	2.751	20	0		GFADML
CSCc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)cc1	ZINC000608955580	566027967	/nfs/dbraw/zinc/02/79/67/566027967.db2.gz	AMBZGZLJXMCCHL-UHFFFAOYSA-N	-3	1	381.431	2.747	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000609588399	566045362	/nfs/dbraw/zinc/04/53/62/566045362.db2.gz	SOIMTESCSYHKCM-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C[S@@](C)=O)c1C	ZINC000609730600	566051252	/nfs/dbraw/zinc/05/12/52/566051252.db2.gz	XKDUXRSQVTXYCM-XMMPIXPASA-N	-2	1	381.475	2.681	20	0		GFADML
O=C([O-])Cc1ccccc1[N-]S(=O)(=O)c1ccc2c3c(cccc31)C(=O)N2	ZINC000819626248	597316546	/nfs/dbraw/zinc/31/65/46/597316546.db2.gz	LWWLNRLGIZTDCU-UHFFFAOYSA-N	-2	1	382.397	2.833	20	0		GFADML
CC[C@@H](C)[C@H](C)N(C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CC1	ZINC000736870243	599774968	/nfs/dbraw/zinc/77/49/68/599774968.db2.gz	KAXQKBQTAKKMIN-KGLIPLIRSA-N	-2	1	385.464	2.832	20	0		GFADML
COC(=O)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(F)cc1Cl	ZINC000737717263	599814390	/nfs/dbraw/zinc/81/43/90/599814390.db2.gz	KDUZCUKGAOWWBS-UHFFFAOYSA-N	-2	1	393.801	2.826	20	0		GFADML
CCOCCOc1ccc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])cc1	ZINC000057819620	599850141	/nfs/dbraw/zinc/85/01/41/599850141.db2.gz	MRJALEQZKLSZRF-UHFFFAOYSA-N	-2	1	383.397	2.740	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)c(C)c1	ZINC000737702452	599853112	/nfs/dbraw/zinc/85/31/12/599853112.db2.gz	MSYCFLSBJNAJAI-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
COC(=O)CSCc1cccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])c1	ZINC000737627011	599926500	/nfs/dbraw/zinc/92/65/00/599926500.db2.gz	DDXZMRCZYQWBCU-UHFFFAOYSA-N	-2	1	395.458	2.592	20	0		GFADML
Cc1cc(C)c(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)c(C(=O)[O-])c1	ZINC000738359622	600235508	/nfs/dbraw/zinc/23/55/08/600235508.db2.gz	VVAWLZRRHBATDZ-UHFFFAOYSA-N	-2	1	385.344	2.779	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)c2cccnc12	ZINC000738063984	600302365	/nfs/dbraw/zinc/30/23/65/600302365.db2.gz	OAWGOSVGYPNVSS-UHFFFAOYSA-N	-2	1	387.417	2.812	20	0		GFADML
O=C([O-])NCc1ccc([N-]S(=O)(=O)c2ccc3c4c(cccc42)C(=O)N3)cc1	ZINC000740000095	600303303	/nfs/dbraw/zinc/30/33/03/600303303.db2.gz	DKVXYIGDYJDYCR-UHFFFAOYSA-N	-2	1	397.412	2.974	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)nc2)cc1C(=O)[O-]	ZINC000588832431	600544603	/nfs/dbraw/zinc/54/46/03/600544603.db2.gz	IFWNHLZPARKSDA-UHFFFAOYSA-N	-2	1	392.433	2.911	20	0		GFADML
Cc1ccnc(-c2ccc([N-]S(=O)(=O)c3ccc(OCC(=O)[O-])cc3)cc2)n1	ZINC000604305148	600611891	/nfs/dbraw/zinc/61/18/91/600611891.db2.gz	CQSLKMKRSAPZHD-UHFFFAOYSA-N	-2	1	399.428	2.716	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)OC2(CCCCC2)O3)c[nH]1	ZINC000624714060	600672503	/nfs/dbraw/zinc/67/25/03/600672503.db2.gz	DXGDOWPQIXCUJS-UHFFFAOYSA-N	-2	1	378.406	2.945	20	0		GFADML
Cc1cccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)c1C(=O)[O-]	ZINC000738743879	600679055	/nfs/dbraw/zinc/67/90/55/600679055.db2.gz	FXDPGFNZQJWNFV-UHFFFAOYSA-N	-3	1	377.418	2.856	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)OC)c(C(=O)[O-])c2)cc1C	ZINC000830094620	600688931	/nfs/dbraw/zinc/68/89/31/600688931.db2.gz	RTNQQFMJWLRQGI-UHFFFAOYSA-N	-2	1	393.417	2.679	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])s1)c1nc(-c2cccc(F)c2)no1	ZINC000827755931	600800702	/nfs/dbraw/zinc/80/07/02/600800702.db2.gz	VGMQNZXAANTKHQ-MRVPVSSYSA-N	-2	1	397.409	2.675	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)cc1	ZINC000484969869	601049233	/nfs/dbraw/zinc/04/92/33/601049233.db2.gz	ZVOBXFBXWRJLHJ-UHFFFAOYSA-N	-2	1	390.461	2.832	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cs1	ZINC000555460809	601203340	/nfs/dbraw/zinc/20/33/40/601203340.db2.gz	PPHZSAAJFGYNGN-HUUCEWRRSA-N	-2	1	397.474	2.929	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)c1ccc(/C=C\C(=O)[O-])cc1	ZINC000830232466	601251071	/nfs/dbraw/zinc/25/10/71/601251071.db2.gz	XVKWQWSFGAAFBH-YHYXMXQVSA-N	-3	1	375.402	2.846	20	0		GFADML
CCOC(=O)/C=C/c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000013278675	601320121	/nfs/dbraw/zinc/32/01/21/601320121.db2.gz	OMRHQSOTNXTYQI-BJMVGYQFSA-N	-2	1	393.392	2.901	20	0		GFADML
CCN(Cc1ccccc1[N-]S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1)C(C)=O	ZINC000737851150	601323443	/nfs/dbraw/zinc/32/34/43/601323443.db2.gz	HGEWAUQHMNTTRZ-UHFFFAOYSA-N	-2	1	394.424	2.693	20	0		GFADML
COC(=O)/C=C/c1ccc(S(=O)(=O)[N-]c2ccc(C)cc2C(=O)[O-])cc1	ZINC000747608218	601324385	/nfs/dbraw/zinc/32/43/85/601324385.db2.gz	FTOCLIAFUJXDPF-UXBLZVDNSA-N	-2	1	375.402	2.680	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1	ZINC000826127447	601333038	/nfs/dbraw/zinc/33/30/38/601333038.db2.gz	VEDSZUDLFGIQPQ-XGICHPGQSA-N	-3	1	389.429	2.947	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])cc(F)c1F	ZINC000833306038	601484181	/nfs/dbraw/zinc/48/41/81/601484181.db2.gz	QNUVIVKYERLMSX-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cc2ccccc2o1)Cc1cccc(F)c1	ZINC000833164051	601563146	/nfs/dbraw/zinc/56/31/46/601563146.db2.gz	NKOROKWICIMAIZ-AWEZNQCLSA-N	-2	1	377.393	2.794	20	0		GFADML
C[C@H](CS(=O)(=O)Nc1cc(C(=O)[O-])ccc1Oc1ccccc1)C(=O)[O-]	ZINC000827571481	601615682	/nfs/dbraw/zinc/61/56/82/601615682.db2.gz	KLRPGLJKMHZNMT-LLVKDONJSA-N	-2	1	379.390	2.640	20	0		GFADML
NC(=O)c1ccc(F)c([N-]S(=O)(=O)c2c3ccccc3sc2C(=O)[O-])c1	ZINC000833085563	601831091	/nfs/dbraw/zinc/83/10/91/601831091.db2.gz	TWQTXJUUZNBIBU-UHFFFAOYSA-N	-2	1	394.405	2.638	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2csnc2C(=O)[O-])c(Br)c1	ZINC000832950622	601831763	/nfs/dbraw/zinc/83/17/63/601831763.db2.gz	PTAHVJHRKNJTNK-UHFFFAOYSA-N	-2	1	377.241	2.713	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-n3nccn3)cc2)c(Cl)cc1F	ZINC000063877628	601835047	/nfs/dbraw/zinc/83/50/47/601835047.db2.gz	PHZQKBXPMIETOW-UHFFFAOYSA-N	-2	1	396.787	2.559	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)ccc1C	ZINC000751146448	601835363	/nfs/dbraw/zinc/83/53/63/601835363.db2.gz	MIOZWHLRRMCJRM-UHFFFAOYSA-N	-2	1	384.360	2.731	20	0		GFADML
CC(C)NC(=O)c1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1	ZINC000751147025	601836503	/nfs/dbraw/zinc/83/65/03/601836503.db2.gz	WYPQEZVBLXIKHR-UHFFFAOYSA-N	-2	1	398.387	2.602	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(N3CCCC3)nc2)ccc1Cl	ZINC000013249865	601843515	/nfs/dbraw/zinc/84/35/15/601843515.db2.gz	ZWROEZSEPNVHMP-UHFFFAOYSA-N	-2	1	381.841	2.834	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@@H]2CCCCCC[C@H]2C(=O)[O-])c(=O)[n-]1	ZINC000832795298	601914645	/nfs/dbraw/zinc/91/46/45/601914645.db2.gz	YCHBXVFOHJAJQA-ZIAGYGMSSA-N	-2	1	381.498	2.685	20	0		GFADML
Cc1cnc([C@@H](C)[N-]S(=O)(=O)c2cc(C(=O)[O-])oc2Br)s1	ZINC000123707296	602162781	/nfs/dbraw/zinc/16/27/81/602162781.db2.gz	GAAFMRZAIUFMSV-ZCFIWIBFSA-N	-2	1	395.256	2.545	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-][C@H](Cc2ccccc2)C(F)(F)F)s1	ZINC000833325135	602214813	/nfs/dbraw/zinc/21/48/13/602214813.db2.gz	SUAZWWDVIFXDPK-LLVKDONJSA-N	-2	1	379.381	2.898	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cc(C3CC3)n[nH]2)c(Br)c1	ZINC000833323565	602307367	/nfs/dbraw/zinc/30/73/67/602307367.db2.gz	NUJWYUCVHOXJNN-UHFFFAOYSA-N	-2	1	386.227	2.549	20	0		GFADML
CC1(C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(F)c3)cc21	ZINC000533165923	602322042	/nfs/dbraw/zinc/32/20/42/602322042.db2.gz	BVQVQYSGCSVUJH-UHFFFAOYSA-N	-2	1	378.381	2.554	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)Nc1ccc(NC(=O)[O-])cc1	ZINC000740206302	602502969	/nfs/dbraw/zinc/50/29/69/602502969.db2.gz	GQBCFOKTDLQOIC-UHFFFAOYSA-N	-2	1	379.376	2.824	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccccc2NC(=O)[O-])cc1NC(C)=O	ZINC000739933959	602652955	/nfs/dbraw/zinc/65/29/55/602652955.db2.gz	WKCVTGUCNFSAAH-UHFFFAOYSA-N	-2	1	379.394	2.544	20	0		GFADML
O=C([O-])NCc1nc(C(=O)[N-]c2nc(Cc3ccccc3)ns2)cs1	ZINC000740684590	602704239	/nfs/dbraw/zinc/70/42/39/602704239.db2.gz	AKJATVFFRJJWGB-UHFFFAOYSA-N	-2	1	375.435	2.605	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c([O-])c1	ZINC000740697900	602845230	/nfs/dbraw/zinc/84/52/30/602845230.db2.gz	KNEMIPZSQSZYEZ-UHFFFAOYSA-N	-2	1	383.404	2.648	20	0		GFADML
CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738715628	602854018	/nfs/dbraw/zinc/85/40/18/602854018.db2.gz	HRVQBVRSTGDWOI-LBPRGKRZSA-N	-2	1	393.440	2.859	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])CCN1C(=O)[O-]	ZINC000826035175	603875908	/nfs/dbraw/zinc/87/59/08/603875908.db2.gz	QHSCXXIMKVTPCY-NSHDSACASA-N	-2	1	379.413	2.564	20	0		GFADML
O=C([O-])C[C@H]1CCCN1c1ccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2)cn1	ZINC000833212335	604469473	/nfs/dbraw/zinc/46/94/73/604469473.db2.gz	ZQPOPFRXSLLICZ-GFCCVEGCSA-N	-2	1	397.403	2.604	20	0		GFADML
CC(C)(C)[C@H](NC(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1[O-])C(=O)[O-]	ZINC000833422261	604710672	/nfs/dbraw/zinc/71/06/72/604710672.db2.gz	BWEITXNPODHZLM-LLVKDONJSA-N	-2	1	392.330	2.732	20	0		GFADML
Cc1cnn(-c2ccc(C)cc2[N-]S(=O)(=O)c2ccc(O)c(C(=O)[O-])c2)c1	ZINC000832909944	605010081	/nfs/dbraw/zinc/01/00/81/605010081.db2.gz	VXOUVDCBJGUQDC-UHFFFAOYSA-N	-2	1	387.417	2.694	20	0		GFADML
COCc1ccc(S(=O)(=O)[N-]c2cccc(CSCC(=O)[O-])c2)cc1	ZINC000833726227	605042618	/nfs/dbraw/zinc/04/26/18/605042618.db2.gz	XHFMAVKAJXJRDT-UHFFFAOYSA-N	-2	1	381.475	2.952	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)[O-])c(F)c2)o1	ZINC000833430363	605274995	/nfs/dbraw/zinc/27/49/95/605274995.db2.gz	AHCDHMQGVGFPJT-UHFFFAOYSA-N	-2	1	399.400	2.838	20	0		GFADML
O=C([O-])N[C@H](CC(=O)OCc1cc(=O)oc2cc([O-])ccc12)c1ccccc1	ZINC000832113362	605556387	/nfs/dbraw/zinc/55/63/87/605556387.db2.gz	BQRZBZBCIMXZEH-MRXNPFEDSA-N	-2	1	383.356	2.941	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCOC[C@@H]2CC(=O)c2cccs2)c([O-])c1	ZINC000834259016	605655800	/nfs/dbraw/zinc/65/58/00/605655800.db2.gz	VIQWSSXNJIXSJO-LBPRGKRZSA-N	-2	1	390.417	2.658	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2C[C@@H](O)C[C@@H]2c2ccc(F)c(F)c2)c([O-])c1	ZINC000834256958	605662371	/nfs/dbraw/zinc/66/23/71/605662371.db2.gz	PSHKELUPZQUXIV-XHDPSFHLSA-N	-2	1	378.331	2.708	20	0		GFADML
O=C([O-])NCCCCC(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000834235756	605902398	/nfs/dbraw/zinc/90/23/98/605902398.db2.gz	VFFZTSOBXNJXQQ-UHFFFAOYSA-N	-2	1	391.449	2.864	20	0		GFADML
O=S(=O)([N-]c1ncc(-c2nn[n-]n2)s1)c1ccccc1-c1ccccc1	ZINC000823589157	607026972	/nfs/dbraw/zinc/02/69/72/607026972.db2.gz	QLCYACTUUGCPJD-UHFFFAOYSA-N	-2	1	384.446	2.791	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(N=S(C)(C)=O)cc1	ZINC000821111752	660316209	/nfs/dbraw/zinc/31/62/09/660316209.db2.gz	UJMWPVKXXVANHW-UHFFFAOYSA-N	-2	1	382.463	2.853	20	0		GFADML
O=C([O-])[C@H](CC(F)F)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F	ZINC000275200289	655222507	/nfs/dbraw/zinc/22/25/07/655222507.db2.gz	GQIHQPMBRNXRGY-ZETCQYMHSA-N	-2	1	381.706	2.746	20	0		GFADML
O=C([N-]NC(=O)c1cc(F)c([O-])c(F)c1)c1cc(F)ccc1Br	ZINC000186779833	655371471	/nfs/dbraw/zinc/37/14/71/655371471.db2.gz	JJXGWUCFIDXDFG-UHFFFAOYSA-N	-2	1	389.127	2.647	20	0		GFADML
O=C([O-])[C@H](C[C@H]1CCOC1)[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000577356159	655457531	/nfs/dbraw/zinc/45/75/31/655457531.db2.gz	BTVGEYUPKNCPOK-KOLCDFICSA-N	-2	1	389.882	2.713	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2F)c1Cl	ZINC000753773176	655858355	/nfs/dbraw/zinc/85/83/55/655858355.db2.gz	VDBHLERRKAPJHO-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CO[C@@H]1Cc2ccc([N-]S(=O)(=O)c3ccc(Cl)c(C(=O)[O-])c3)cc2C1	ZINC000783861606	657265844	/nfs/dbraw/zinc/26/58/44/657265844.db2.gz	IICBJBJIVNZDPN-CYBMUJFWSA-N	-2	1	381.837	2.953	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]CCCCCC(=O)[O-])c(F)cc1Cl	ZINC000841777479	661312482	/nfs/dbraw/zinc/31/24/82/661312482.db2.gz	DSLYYIZFICXLSS-UHFFFAOYSA-N	-2	1	395.836	2.579	20	0		GFADML
C[C@@H](C[N-]S(=O)(=O)c1sc(C(=O)[O-])cc1Br)CC(F)F	ZINC000843288040	661375990	/nfs/dbraw/zinc/37/59/90/661375990.db2.gz	JNYDUBLOOKYVSQ-RXMQYKEDSA-N	-2	1	392.243	2.778	20	0		GFADML
COc1cc(C(=O)N[C@H]2CCSC3(CC(C(=O)[O-])C3)C2)cc(Cl)c1[O-]	ZINC000908175247	664089648	/nfs/dbraw/zinc/08/96/48/664089648.db2.gz	SXBDHWFFHBAMIE-GCULGPDHSA-N	-2	1	385.869	2.913	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1Cl	ZINC000055677350	551174516	/nfs/dbraw/zinc/17/45/16/551174516.db2.gz	AAFPBXZKOKCHIA-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
CCC[C@@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000262668998	553174169	/nfs/dbraw/zinc/17/41/69/553174169.db2.gz	OOUOPZCDLZZYBC-RXMQYKEDSA-N	-2	1	376.681	2.696	20	0		GFADML
COC(=O)c1sccc1S(=O)(=O)[N-]c1c(Cl)cccc1C(=O)[O-]	ZINC000324334237	563452271	/nfs/dbraw/zinc/45/22/71/563452271.db2.gz	XISHLXOMYOYTMZ-UHFFFAOYSA-N	-2	1	375.811	2.687	20	0		GFADML
C[C@H]1C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(Cl)cc3C(=O)[O-])cc21	ZINC000326732299	563455960	/nfs/dbraw/zinc/45/59/60/563455960.db2.gz	HMRAIYVWXLDNKP-MRVPVSSYSA-N	-2	1	380.809	2.895	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(F)c2)ccc1Cl	ZINC000327911698	563460029	/nfs/dbraw/zinc/46/00/29/563460029.db2.gz	KDBPXBPUGXQYKU-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(O)c2)cc1Br	ZINC000436638161	563675511	/nfs/dbraw/zinc/67/55/11/563675511.db2.gz	BWRXIUSGQKMUFW-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)c(C(N)=O)c2)cc(C(=O)[O-])c1C	ZINC000471124000	564186366	/nfs/dbraw/zinc/18/63/66/564186366.db2.gz	IWBNVKZEDRDAAB-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc([S@](C)=O)c1	ZINC000476394839	564338164	/nfs/dbraw/zinc/33/81/64/564338164.db2.gz	CTAGVVRPHOCFNW-QHCPKHFHSA-N	-2	1	387.866	2.885	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1Cl	ZINC000477425680	564377132	/nfs/dbraw/zinc/37/71/32/564377132.db2.gz	OHCGHHSWHOHKJY-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccccc2C[S@@](C)=O)c1C	ZINC000569283800	564457274	/nfs/dbraw/zinc/45/72/74/564457274.db2.gz	PQAFSDAFRCWWHX-XMMPIXPASA-N	-2	1	381.475	2.681	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cc(F)ccc1F)Cc1ccccc1Cl	ZINC000547556737	564494347	/nfs/dbraw/zinc/49/43/47/564494347.db2.gz	DEOUXXOTINALPK-LLVKDONJSA-N	-2	1	389.807	2.840	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)Nc2cc(Cl)c(Cl)c(C(=O)[O-])c2)c[nH]1	ZINC000481437326	564512404	/nfs/dbraw/zinc/51/24/04/564512404.db2.gz	OPGBKPQZLXMHGB-UHFFFAOYSA-N	-2	1	379.177	2.519	20	0		GFADML
Cc1cc(C(=O)N[C@H]2CCc3sc(Cl)cc32)[n-]c2nc(=O)[n-]c(=O)c1-2	ZINC000522050662	564643463	/nfs/dbraw/zinc/64/34/63/564643463.db2.gz	LAFDJYUGOIXUOK-QMMMGPOBSA-N	-2	1	376.825	2.877	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)[C@@H](C)C(=O)[O-]	ZINC000574534701	564678281	/nfs/dbraw/zinc/67/82/81/564678281.db2.gz	WUHORZPHUHNPMD-PHDIDXHHSA-N	-2	1	388.642	2.629	20	0		GFADML
CC[C@@H](C)Oc1cc(C)ccc1C[N-]S(=O)(=O)c1csnc1C(=O)[O-]	ZINC000580831146	564775429	/nfs/dbraw/zinc/77/54/29/564775429.db2.gz	FGXFUCSCTRAPRS-LLVKDONJSA-N	-2	1	384.479	2.806	20	0		GFADML
C[C@H](CSCC[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl)C(=O)[O-]	ZINC000592448451	565276673	/nfs/dbraw/zinc/27/66/73/565276673.db2.gz	DLZJCUSAHFKUDQ-SSDOTTSWSA-N	-2	1	390.285	2.865	20	0		GFADML
O=C([O-])C[C@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1ccc(F)cc1F	ZINC000681574163	566114756	/nfs/dbraw/zinc/11/47/56/566114756.db2.gz	DMBXNSUGJKDYQF-ZDUSSCGKSA-N	-2	1	377.315	2.737	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2cc(Cl)c(Cl)cc2Br)CC1	ZINC000656516177	566132226	/nfs/dbraw/zinc/13/22/26/566132226.db2.gz	SLZGIIDKSDMUPO-UHFFFAOYSA-N	-2	1	389.054	2.651	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)N(C)[C@H](C)C(=O)[O-])c1	ZINC000262907941	597465721	/nfs/dbraw/zinc/46/57/21/597465721.db2.gz	RKUHKKRAVQWKPD-CQSZACIVSA-N	-2	1	390.461	2.649	20	0		GFADML
CN(CCCC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1)C(=O)[O-]	ZINC000737431262	599733645	/nfs/dbraw/zinc/73/36/45/599733645.db2.gz	RHUUTWGHUCWXDY-UHFFFAOYSA-N	-2	1	391.449	2.816	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NC[C@@H](C)C(=O)[O-])cc2)cc1C	ZINC000262493259	599778881	/nfs/dbraw/zinc/77/88/81/599778881.db2.gz	GOJHXXLTBCZCDI-CQSZACIVSA-N	-2	1	390.461	2.555	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CCC(=O)[O-])cc1	ZINC000738291303	599853092	/nfs/dbraw/zinc/85/30/92/599853092.db2.gz	OMBBQDRMUQNBNZ-UHFFFAOYSA-N	-3	1	381.381	2.650	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])ccc1C(=O)NC(C)C	ZINC000738463489	599908889	/nfs/dbraw/zinc/90/88/89/599908889.db2.gz	HNHUWYUPONBMAS-UHFFFAOYSA-N	-2	1	376.434	2.632	20	0		GFADML
CSCc1cccc(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000738196496	600073409	/nfs/dbraw/zinc/07/34/09/600073409.db2.gz	QYBSEVHIHDWCHM-UHFFFAOYSA-N	-2	1	397.456	2.908	20	0		GFADML
C[C@@H]1c2ccccc2CCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736840531	600075423	/nfs/dbraw/zinc/07/54/23/600075423.db2.gz	NXMZEVWJBBDSKK-CQSZACIVSA-N	-2	1	391.427	2.552	20	0		GFADML
COC(=O)Nc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)ccc1F	ZINC000066587913	600100241	/nfs/dbraw/zinc/10/02/41/600100241.db2.gz	MYAMITOPRFRYGQ-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
O=C([O-])[C@@H]1C[C@@H]1C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1	ZINC000739552650	600102955	/nfs/dbraw/zinc/10/29/55/600102955.db2.gz	JHMMTRLKBVMQRO-LSDHHAIUSA-N	-2	1	394.836	2.800	20	0		GFADML
O=C([O-])c1ccnc([N-]S(=O)(=O)/C=C\c2ccccc2Br)c1	ZINC000740248697	600577085	/nfs/dbraw/zinc/57/70/85/600577085.db2.gz	IHCWQRCAGVNUMH-VURMDHGXSA-N	-2	1	383.223	2.955	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3n[nH]c(C4CC4)n3)c2)cc1	ZINC000481957910	600627545	/nfs/dbraw/zinc/62/75/45/600627545.db2.gz	RBGGQZGMFCNDPT-UHFFFAOYSA-N	-2	1	398.444	2.777	20	0		GFADML
Cc1cnn(-c2ccc([N-]S(=O)(=O)c3cc(F)ccc3C(=O)[O-])cc2F)c1	ZINC000738810205	600636686	/nfs/dbraw/zinc/63/66/86/600636686.db2.gz	UGJUDXYFERKJTP-UHFFFAOYSA-N	-2	1	393.371	2.958	20	0		GFADML
COC(=O)CCCOc1ccc([N-]S(=O)(=O)c2csc(C(=O)[O-])c2)cc1	ZINC000264891562	600682087	/nfs/dbraw/zinc/68/20/87/600682087.db2.gz	XSJAZMMNSVZKDM-UHFFFAOYSA-N	-2	1	399.446	2.579	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])ccc1C(=O)N(C)C	ZINC000738463747	600694722	/nfs/dbraw/zinc/69/47/22/600694722.db2.gz	UEPHTTITFSCUSU-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)NC(C)(C)CC(=O)[O-])cc2)cc1	ZINC000738632528	600788678	/nfs/dbraw/zinc/78/86/78/600788678.db2.gz	GFDBZPRDZCMXAD-UHFFFAOYSA-N	-2	1	390.461	2.779	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1csc(C(=O)[O-])c1)c1nc(-c2cccc(F)c2)no1	ZINC000827767580	600800719	/nfs/dbraw/zinc/80/07/19/600800719.db2.gz	DOKSYUPUUJRVKF-QMMMGPOBSA-N	-2	1	397.409	2.675	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)N(C)C)c2)cc1C(=O)[O-]	ZINC000032630363	600810106	/nfs/dbraw/zinc/81/01/06/600810106.db2.gz	CHJONNZMVHPPQC-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
O=C([O-])CCCc1nnc([N-]C(=O)c2cnc(-c3ccncc3)s2)s1	ZINC000739712404	600845826	/nfs/dbraw/zinc/84/58/26/600845826.db2.gz	UDBJQXXEZKRBHB-UHFFFAOYSA-N	-2	1	375.435	2.716	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c(C)c1	ZINC000737124094	600890611	/nfs/dbraw/zinc/89/06/11/600890611.db2.gz	VXCGHVKDXRZBLL-UHFFFAOYSA-N	-2	1	396.852	2.897	20	0		GFADML
C[C@H]1c2ccccc2CN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000828528515	601084808	/nfs/dbraw/zinc/08/48/08/601084808.db2.gz	WGHLLFAUVVHTCL-ZDUSSCGKSA-N	-2	1	377.400	2.510	20	0		GFADML
O=C([O-])c1cc(Br)ccc1S(=O)(=O)[N-]c1c(O)cccc1F	ZINC000740067013	601117196	/nfs/dbraw/zinc/11/71/96/601117196.db2.gz	ANNNBHWRRLRJHG-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)OC(F)(F)O3)ccc1F	ZINC000013032185	601319531	/nfs/dbraw/zinc/31/95/31/601319531.db2.gz	LLSZRNXPUQUHFK-UHFFFAOYSA-N	-2	1	375.280	2.646	20	0		GFADML
COC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1	ZINC000831198965	601326356	/nfs/dbraw/zinc/32/63/56/601326356.db2.gz	VEUKPKCJNDEPAZ-LFYBBSHMSA-N	-2	1	390.417	2.788	20	0		GFADML
CN1CCOc2ccc([N-]S(=O)(=O)c3cc(Cl)cc(C(=O)[O-])c3)cc21	ZINC000830964101	601362353	/nfs/dbraw/zinc/36/23/53/601362353.db2.gz	HLTRQRAIQRACIK-UHFFFAOYSA-N	-2	1	382.825	2.668	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])o1)c1noc(-c2ccc(Cl)cc2)n1	ZINC000827754390	601404653	/nfs/dbraw/zinc/40/46/53/601404653.db2.gz	KMXLTGPWKYGHSX-QMMMGPOBSA-N	-2	1	397.796	2.721	20	0		GFADML
C/C(=C\COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)cc2)cc1)C(=O)[O-]	ZINC000825780846	601413423	/nfs/dbraw/zinc/41/34/23/601413423.db2.gz	JPEGZMDSSRVDLR-SDNWHVSQSA-N	-2	1	389.429	2.984	20	0		GFADML
CC(C)Oc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)[O-])c1	ZINC000443363085	601574850	/nfs/dbraw/zinc/57/48/50/601574850.db2.gz	ABGKLMNJDINVEO-UHFFFAOYSA-N	-2	1	379.390	2.671	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(O)c(C(=O)[O-])c1	ZINC000832934672	601629819	/nfs/dbraw/zinc/62/98/19/601629819.db2.gz	RMWZBTQRHFKRCF-UHFFFAOYSA-N	-3	1	385.781	2.551	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)OCc1cc(C(=O)[O-])sc1C	ZINC000830136862	601725821	/nfs/dbraw/zinc/72/58/21/601725821.db2.gz	MAWNPLUFNFTKGL-UHFFFAOYSA-N	-2	1	383.447	2.873	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C(=O)CCC(=O)[O-])c1	ZINC000469083995	601788203	/nfs/dbraw/zinc/78/82/03/601788203.db2.gz	UMBXTTAPGBUTHF-UHFFFAOYSA-N	-3	1	391.401	2.542	20	0		GFADML
CC(=O)N1CCc2cc([N-]S(=O)(=O)c3ccc(Cl)c(C(=O)[O-])c3)ccc21	ZINC000013093417	601826413	/nfs/dbraw/zinc/82/64/13/601826413.db2.gz	QPMTUPNRVUJLGD-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)cc2)ccc1Cl	ZINC000013060405	601826495	/nfs/dbraw/zinc/82/64/95/601826495.db2.gz	IWVNZLFXBXRHDV-UHFFFAOYSA-N	-2	1	394.836	2.966	20	0		GFADML
Cc1cnn(-c2ccc(S(=O)(=O)[N-]c3ccsc3C(=O)[O-])cc2F)c1	ZINC000832987659	601856668	/nfs/dbraw/zinc/85/66/68/601856668.db2.gz	WEXCAGJWSHLVFI-UHFFFAOYSA-N	-2	1	381.410	2.880	20	0		GFADML
Cc1ccc(C(=O)NC2CC2)cc1[N-]S(=O)(=O)c1cccc(F)c1C(=O)[O-]	ZINC000832911280	601857803	/nfs/dbraw/zinc/85/78/03/601857803.db2.gz	LWSFYFNIEZAVBF-UHFFFAOYSA-N	-2	1	392.408	2.525	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2c(C)ccc(Cl)c2C(=O)[O-])cc1C(=O)[O-]	ZINC000444673271	601881025	/nfs/dbraw/zinc/88/10/25/601881025.db2.gz	HTBRXZWIGIOBIG-UHFFFAOYSA-N	-3	1	399.808	2.854	20	0		GFADML
CC(C)n1ncc2cc(S(=O)(=O)[N-]c3ccc4[nH]nc(C(=O)[O-])c4c3)ccc21	ZINC000827207272	601928999	/nfs/dbraw/zinc/92/89/99/601928999.db2.gz	ONOZEKHJIJRBEW-UHFFFAOYSA-N	-2	1	399.432	2.993	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1sccc1Br)[C@@H]1CCCN(C(=O)[O-])C1	ZINC000739036345	601991428	/nfs/dbraw/zinc/99/14/28/601991428.db2.gz	DJFXVORAJLHMQY-DTWKUNHWSA-N	-2	1	397.316	2.567	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CCC(=O)Nc1ccc(NC(=O)[O-])nc1	ZINC000740206287	602036570	/nfs/dbraw/zinc/03/65/70/602036570.db2.gz	GDVNNODILHYCRV-UHFFFAOYSA-N	-2	1	394.391	2.609	20	0		GFADML
CC(C)C[C@@H]1CCCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000826832685	602061206	/nfs/dbraw/zinc/06/12/06/602061206.db2.gz	USVYNBFBNSPTGU-SFHVURJKSA-N	-2	1	385.464	2.834	20	0		GFADML
O=C([O-])c1csc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)c1	ZINC000833343840	602118443	/nfs/dbraw/zinc/11/84/43/602118443.db2.gz	RUSVTKFKXIKBTQ-UHFFFAOYSA-N	-2	1	379.774	2.738	20	0		GFADML
CCCc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])cc(S(C)(=O)=O)c2)cc1	ZINC000476372239	602123667	/nfs/dbraw/zinc/12/36/67/602123667.db2.gz	ALVYHHYIOJKNBR-UHFFFAOYSA-N	-2	1	397.474	2.542	20	0		GFADML
CC(=O)N1CCCc2cc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(F)c3)ccc21	ZINC000677234957	602322548	/nfs/dbraw/zinc/32/25/48/602322548.db2.gz	VIJVSTQHUAOFGM-UHFFFAOYSA-N	-2	1	392.408	2.624	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)ccc1C	ZINC000738559123	602779048	/nfs/dbraw/zinc/77/90/48/602779048.db2.gz	DTRJGXZVFIAOFZ-UHFFFAOYSA-N	-2	1	391.449	2.864	20	0		GFADML
COCCOc1cc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])ccc1OC	ZINC000739834971	602847170	/nfs/dbraw/zinc/84/71/70/602847170.db2.gz	MCRJIMSEKCQYHU-UHFFFAOYSA-N	-2	1	376.365	2.768	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCCN(C(=O)[O-])CC2)c([O-])c1	ZINC000737583408	602852427	/nfs/dbraw/zinc/85/24/27/602852427.db2.gz	AKHVQFGPQOXQBU-UHFFFAOYSA-N	-2	1	379.413	2.565	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccccc2CN(C)C(=O)[O-])cc1	ZINC000823539426	603240512	/nfs/dbraw/zinc/24/05/12/603240512.db2.gz	YCCUTXKMFFYYLP-UHFFFAOYSA-N	-2	1	391.449	2.580	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)cc1C	ZINC000828788241	603403104	/nfs/dbraw/zinc/40/31/04/603403104.db2.gz	DDLVEBXMLIKWSB-GFCCVEGCSA-N	-2	1	392.433	2.911	20	0		GFADML
CC1(C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])cc3)cc21	ZINC000825696470	603494589	/nfs/dbraw/zinc/49/45/89/603494589.db2.gz	LUPZMTHVCYWEOJ-UHFFFAOYSA-N	-2	1	375.406	2.807	20	0		GFADML
CCN(Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)N(C)CC2)C(=O)[O-]	ZINC000827187280	603877099	/nfs/dbraw/zinc/87/70/99/603877099.db2.gz	WGFAGHLEVKKLPW-UHFFFAOYSA-N	-2	1	389.477	2.980	20	0		GFADML
CCc1nc(-c2ccccc2[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)n[nH]1	ZINC000535894685	604537296	/nfs/dbraw/zinc/53/72/96/604537296.db2.gz	HPJGPDBRXVSGMR-UHFFFAOYSA-N	-2	1	386.433	2.842	20	0		GFADML
CN(C(=O)c1ccc(NC(=O)[O-])cc1[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000827937926	604920690	/nfs/dbraw/zinc/92/06/90/604920690.db2.gz	DBZSCJCORNBVEO-LBPRGKRZSA-N	-2	1	379.413	2.564	20	0		GFADML
CC(C)(C)NC(=O)c1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000485279731	605160446	/nfs/dbraw/zinc/16/04/46/605160446.db2.gz	ANLGGOPAVXMIJB-UHFFFAOYSA-N	-2	1	394.424	2.853	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])c(F)c2)cc1	ZINC000833388483	605264212	/nfs/dbraw/zinc/26/42/12/605264212.db2.gz	QYUPPALDNQJFQQ-UHFFFAOYSA-N	-2	1	381.385	2.699	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2ccccc2N2CCC(CO)CC2)c([O-])c1	ZINC000834256591	605655909	/nfs/dbraw/zinc/65/59/09/605655909.db2.gz	QQWMLGDKJGWNKA-UHFFFAOYSA-N	-2	1	385.420	2.943	20	0		GFADML
CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2nc3cccc(C(=O)[O-])c3[nH]2)cc1	ZINC000833467572	605783293	/nfs/dbraw/zinc/78/32/93/605783293.db2.gz	ZHMJNHAVZINVHF-UHFFFAOYSA-N	-2	1	387.417	2.901	20	0		GFADML
COC[C@H]([N-]S(=O)(=O)c1cc(F)c(Cl)c(C(=O)[O-])c1)c1ccc(C)o1	ZINC000273630032	655151454	/nfs/dbraw/zinc/15/14/54/655151454.db2.gz	CJNGMZHHLNCHCX-LBPRGKRZSA-N	-2	1	391.804	2.745	20	0		GFADML
CN(C)C(=O)Sc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1	ZINC000728508655	655556078	/nfs/dbraw/zinc/55/60/78/655556078.db2.gz	YSHXSHYFCCDEFB-UHFFFAOYSA-N	-2	1	380.447	2.959	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c(C(=O)[O-])c1	ZINC000758164879	655924930	/nfs/dbraw/zinc/92/49/30/655924930.db2.gz	UFBBQEPZSNVSJZ-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
CC(C)(C)c1cc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)[nH]n1	ZINC000767740002	656218072	/nfs/dbraw/zinc/21/80/72/656218072.db2.gz	UKHUDMKTEPMFRK-UHFFFAOYSA-N	-2	1	375.809	2.999	20	0		GFADML
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccsc1	ZINC000776445729	656742666	/nfs/dbraw/zinc/74/26/66/656742666.db2.gz	QKJHBTMHTXFTHP-SECBINFHSA-N	-2	1	381.262	2.944	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccccc1	ZINC000788455970	657724051	/nfs/dbraw/zinc/72/40/51/657724051.db2.gz	JIDPQVUFQHKXSR-JTQLQIEISA-N	-2	1	375.233	2.535	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]CCC[C@H]2CC2(Cl)Cl)c1	ZINC000844902436	661448719	/nfs/dbraw/zinc/44/87/19/661448719.db2.gz	QUZVGZGBTFIZMU-QMMMGPOBSA-N	-2	1	388.219	2.915	20	0		GFADML
COc1cnc([C@@H]2CCCN2C(=O)c2cccc(Br)c2[O-])[n-]c1=O	ZINC000889789959	663267107	/nfs/dbraw/zinc/26/71/07/663267107.db2.gz	LJDYUZFBHPOGMG-NSHDSACASA-N	-2	1	394.225	2.636	20	0		GFADML
COc1ccc(Br)c(S(=O)(=O)[N-]C(C)(C)CCC(=O)[O-])c1F	ZINC000905184120	663857158	/nfs/dbraw/zinc/85/71/58/663857158.db2.gz	NWEHAGBLJYXFLL-UHFFFAOYSA-N	-2	1	398.250	2.519	20	0		GFADML
Cc1cc(C(=O)NCc2ccc(Cl)cc2Cl)[n-]c2nc(=O)[n-]c(=O)c1-2	ZINC000151467832	551414243	/nfs/dbraw/zinc/41/42/43/551414243.db2.gz	AVICNNPSWKBASR-UHFFFAOYSA-N	-2	1	379.203	2.569	20	0		GFADML
Cc1cc(Br)cc(C)c1[N-]S(=O)(=O)c1cc(C(=O)[O-])n(C)c1	ZINC000314377184	563439284	/nfs/dbraw/zinc/43/92/84/563439284.db2.gz	QBIJKJBUORTATC-UHFFFAOYSA-N	-2	1	387.255	2.903	20	0		GFADML
Cc1c(Br)cc(S(=O)(=O)[N-]c2cccc(O)c2)cc1C(=O)[O-]	ZINC000316246112	563441474	/nfs/dbraw/zinc/44/14/74/563441474.db2.gz	VODDFVOKCPZNSL-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc(NC(N)=O)cc1	ZINC000327003226	563456659	/nfs/dbraw/zinc/45/66/59/563456659.db2.gz	BAORCBNGAFDQIV-UHFFFAOYSA-N	-2	1	383.813	2.638	20	0		GFADML
C[C@H]1C(=O)Nc2ccc(S(=O)(=O)[N-]c3cccc(Cl)c3C(=O)[O-])cc21	ZINC000327441988	563457778	/nfs/dbraw/zinc/45/77/78/563457778.db2.gz	RFOJPSOSCZLYSO-MRVPVSSYSA-N	-2	1	380.809	2.895	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)CS3)ccc1C(=O)[O-]	ZINC000327943060	563459860	/nfs/dbraw/zinc/45/98/60/563459860.db2.gz	RFHUYYWKQZWHNF-UHFFFAOYSA-N	-2	1	378.431	2.538	20	0		GFADML
COc1cc(C(=O)Nc2ccc(F)cc2[N-]S(C)(=O)=O)cc(Cl)c1O	ZINC000443132844	563793172	/nfs/dbraw/zinc/79/31/72/563793172.db2.gz	MRPNQHDKNLRUKB-UHFFFAOYSA-N	-2	1	388.804	2.817	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(N)=O)c(Cl)c2)cc(C(=O)[O-])c1C	ZINC000471125008	564186360	/nfs/dbraw/zinc/18/63/60/564186360.db2.gz	MQKBOKCCQMMDKT-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1nc(C2([N-]S(=O)(=O)c3cc(C(=O)[O-])cs3)CCCCCC2)no1	ZINC000563963394	564214360	/nfs/dbraw/zinc/21/43/60/564214360.db2.gz	GXTKCBIYVPLPBB-UHFFFAOYSA-N	-2	1	385.467	2.666	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CC(=O)[O-])cc1	ZINC000545125375	564409316	/nfs/dbraw/zinc/40/93/16/564409316.db2.gz	MRKWTTGQXJEBKR-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(N)=O)c2)c(C)c1C(=O)[O-]	ZINC000512751673	564410879	/nfs/dbraw/zinc/41/08/79/564410879.db2.gz	CMXPOBKMPKJBSB-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc3oc(=O)[nH]c3c2)cc1C(=O)[O-]	ZINC000479242815	564432857	/nfs/dbraw/zinc/43/28/57/564432857.db2.gz	JWXQWVZHWQDBDR-UHFFFAOYSA-N	-2	1	382.781	2.994	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc2[nH]c(=O)ccc2c1	ZINC000547559749	564494123	/nfs/dbraw/zinc/49/41/23/564494123.db2.gz	SXRJWKNEAZXITI-UHFFFAOYSA-N	-2	1	378.793	2.681	20	0		GFADML
CCC[C@H](O)[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)[O-]	ZINC000547613302	564503071	/nfs/dbraw/zinc/50/30/71/564503071.db2.gz	SZIGONFCQZQMAM-VHSXEESVSA-N	-2	1	390.672	2.539	20	0		GFADML
CCC[C@@H](O)[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)[O-]	ZINC000547613299	564503489	/nfs/dbraw/zinc/50/34/89/564503489.db2.gz	SZIGONFCQZQMAM-NXEZZACHSA-N	-2	1	390.672	2.539	20	0		GFADML
CN(C)C(=O)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])c1	ZINC000517897226	564543237	/nfs/dbraw/zinc/54/32/37/564543237.db2.gz	WAELFVMVSSSXCA-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
Cc1cc(Br)c([O-])c([N-]S(=O)(=O)CCOCC(F)(F)F)c1	ZINC000572450523	564595445	/nfs/dbraw/zinc/59/54/45/564595445.db2.gz	IRJNTCFAALWQIA-UHFFFAOYSA-N	-2	1	392.193	2.784	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2cccc(CC(=O)[O-])c2)ccc1Cl	ZINC000579896671	564753377	/nfs/dbraw/zinc/75/33/77/564753377.db2.gz	SBSYFBQRDVUZNP-UHFFFAOYSA-N	-2	1	382.825	2.726	20	0		GFADML
CC1(C)SC[C@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000555232129	564787389	/nfs/dbraw/zinc/78/73/89/564787389.db2.gz	QYQGLHVJOCUNDL-CYBMUJFWSA-N	-2	1	398.531	2.878	20	0		GFADML
Cc1c(C(=O)[O-])cc(Br)cc1S(=O)(=O)[N-]c1cccc(O)c1	ZINC000534977676	565000456	/nfs/dbraw/zinc/00/04/56/565000456.db2.gz	XSMRZZDSEOWTIA-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
COc1cccc([N-]S(=O)(=O)c2cc(Br)cc(C(=O)[O-])c2)c1	ZINC000534971764	565000747	/nfs/dbraw/zinc/00/07/47/565000747.db2.gz	HRBCHKOMWTZZSQ-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C(F)F	ZINC000685209789	565099641	/nfs/dbraw/zinc/09/96/41/565099641.db2.gz	FGWUYIWNYNOWRS-LURJTMIESA-N	-2	1	395.733	2.993	20	0		GFADML
C[C@@H]1SCC[C@@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000649175452	565751705	/nfs/dbraw/zinc/75/17/05/565751705.db2.gz	UKQGUMYHMMTNIH-GWCFXTLKSA-N	-2	1	398.531	2.878	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(C)c2C(=O)[O-])c1	ZINC000610193849	566070193	/nfs/dbraw/zinc/07/01/93/566070193.db2.gz	TUGOUMWLDVRONR-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
C[C@@H](C[N-]S(=O)(=O)c1cc(Cl)c(Cl)cc1Br)C(=O)[O-]	ZINC000656509045	566128828	/nfs/dbraw/zinc/12/88/28/566128828.db2.gz	JPZHDOSFDKIAHF-YFKPBYRVSA-N	-2	1	391.070	2.755	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)NC[C@H](C)C(=O)[O-])c1	ZINC000262487371	599775453	/nfs/dbraw/zinc/77/54/53/599775453.db2.gz	FPVJEIHKFGUNEX-AWEZNQCLSA-N	-2	1	390.461	2.555	20	0		GFADML
COC(=O)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cc(Cl)ccc1F	ZINC000737716574	599814293	/nfs/dbraw/zinc/81/42/93/599814293.db2.gz	BVYXHNAHPYYCLO-UHFFFAOYSA-N	-2	1	393.801	2.826	20	0		GFADML
CCc1cc2c(COC(=O)[C@H](CC(C)C)NC(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000737252868	599882371	/nfs/dbraw/zinc/88/23/71/599882371.db2.gz	UKWRTMJLTYQHME-AWEZNQCLSA-N	-2	1	377.393	2.787	20	0		GFADML
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)[N-]S(=O)(=O)c1cc(F)c(F)cc1F	ZINC000547556947	599894914	/nfs/dbraw/zinc/89/49/14/599894914.db2.gz	GMPHJJLFECBVOC-OAHLLOKOSA-N	-2	1	398.362	2.559	20	0		GFADML
O=C([O-])CSCc1cccc(NS(=O)(=O)c2csc(C(=O)[O-])c2)c1	ZINC000739874710	599928034	/nfs/dbraw/zinc/92/80/34/599928034.db2.gz	WUVMIRHOMALULR-UHFFFAOYSA-N	-2	1	387.460	2.565	20	0		GFADML
Cc1ccc(NC(=O)C2CC2)cc1[N-]S(=O)(=O)c1cc(F)ccc1C(=O)[O-]	ZINC000738616279	600096667	/nfs/dbraw/zinc/09/66/67/600096667.db2.gz	QRVJUYSAAMTAEF-UHFFFAOYSA-N	-2	1	392.408	2.982	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3cc(F)ccc3C(=O)[O-])c2)no1	ZINC000738831359	600098096	/nfs/dbraw/zinc/09/80/96/600098096.db2.gz	AHZQDNSLGALEMG-UHFFFAOYSA-N	-2	1	377.353	2.683	20	0		GFADML
O=C([O-])c1ccc(N2CCCC2)c([N-]S(=O)(=O)c2ccc3c(c2)COC3)c1	ZINC000740143652	600104128	/nfs/dbraw/zinc/10/41/28/600104128.db2.gz	JHJREPRMUXAYJT-UHFFFAOYSA-N	-2	1	388.445	2.816	20	0		GFADML
CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)cc1	ZINC000736846534	600302298	/nfs/dbraw/zinc/30/22/98/600302298.db2.gz	FYBHNDDZMMJNAN-UHFFFAOYSA-N	-2	1	377.422	2.604	20	0		GFADML
CCN(C(=O)c1ccc(S(=O)(=O)[N-]C(C)(C)C)o1)c1ccccc1C(=O)[O-]	ZINC000737059316	600532553	/nfs/dbraw/zinc/53/25/53/600532553.db2.gz	NCDFIWFQKNQMPR-UHFFFAOYSA-N	-2	1	394.449	2.721	20	0		GFADML
CC(=O)N1CCc2ccc(S(=O)(=O)[N-]c3ccc(Cl)c(C(=O)[O-])c3)cc21	ZINC000547545489	600612021	/nfs/dbraw/zinc/61/20/21/600612021.db2.gz	KOBXADYCQIZSEZ-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3cccc(OCC(=O)[O-])c3)cc(Cl)c2O1	ZINC000736825488	600635536	/nfs/dbraw/zinc/63/55/36/600635536.db2.gz	MPQNCEGKJWOBRF-SNVBAGLBSA-N	-2	1	397.836	2.928	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])ccc1C(=O)N(C)C	ZINC000738464004	600694732	/nfs/dbraw/zinc/69/47/32/600694732.db2.gz	UHYULTIVOVVFFT-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3ccc(C)c(C(=O)[O-])c3)cn2)n1	ZINC000032595518	600809796	/nfs/dbraw/zinc/80/97/96/600809796.db2.gz	GOIFPLSYTVTXPZ-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000736065043	600816215	/nfs/dbraw/zinc/81/62/15/600816215.db2.gz	TWFSQTVZXCOYLH-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737697761	600886801	/nfs/dbraw/zinc/88/68/01/600886801.db2.gz	SDWPLPJFCUPSAM-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(O[C@@H]3CCCC[C@@H]3O)cc2)cs1	ZINC000555460810	601203365	/nfs/dbraw/zinc/20/33/65/601203365.db2.gz	PPHZSAAJFGYNGN-LSDHHAIUSA-N	-2	1	397.474	2.929	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3cc(C(=O)[O-])ccc3C)c2)n[nH]1	ZINC000484642952	601205396	/nfs/dbraw/zinc/20/53/96/601205396.db2.gz	RMHJMGYGFHTHJQ-UHFFFAOYSA-N	-2	1	386.433	2.896	20	0		GFADML
O=C([O-])Nc1cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)ccc1F	ZINC000833283261	601233369	/nfs/dbraw/zinc/23/33/69/601233369.db2.gz	QHIWWZDZILLFPH-UHFFFAOYSA-N	-3	1	390.295	2.693	20	0		GFADML
O=C([O-])c1cc(Cl)cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1	ZINC000833298373	601234373	/nfs/dbraw/zinc/23/43/73/601234373.db2.gz	ZETFLZHXNWPVHZ-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
COC[C@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000831584007	601266445	/nfs/dbraw/zinc/26/64/45/601266445.db2.gz	CAEGZJALQWXZHD-LBPRGKRZSA-N	-2	1	390.672	2.805	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(CC(=O)[O-])cc2)c1	ZINC000547242739	601320529	/nfs/dbraw/zinc/32/05/29/601320529.db2.gz	ZCICPINUFFNNNA-UHFFFAOYSA-N	-2	1	377.418	2.518	20	0		GFADML
CCCNC(=O)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000614802068	601323276	/nfs/dbraw/zinc/32/32/76/601323276.db2.gz	QIXZXNYNRPMUAZ-UHFFFAOYSA-N	-2	1	390.461	2.942	20	0		GFADML
CCc1nnc(-c2ccc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)cc2)o1	ZINC000743266441	601333204	/nfs/dbraw/zinc/33/32/04/601333204.db2.gz	MQQSJYJEDOTPRE-UHFFFAOYSA-N	-2	1	391.380	2.937	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)CCCN2C	ZINC000832204231	601360286	/nfs/dbraw/zinc/36/02/86/601360286.db2.gz	PPPMZWGIAQBQQI-UHFFFAOYSA-N	-2	1	376.434	2.577	20	0		GFADML
CC(C)n1ncc2cc([N-]S(=O)(=O)c3cc(F)c(F)c(C(=O)[O-])c3)cnc21	ZINC000751145304	601834164	/nfs/dbraw/zinc/83/41/64/601834164.db2.gz	DTVHUOOVJCXDEU-UHFFFAOYSA-N	-2	1	396.375	2.789	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1cccc(NC(=O)C2CC2)c1	ZINC000833294937	601858596	/nfs/dbraw/zinc/85/85/96/601858596.db2.gz	NQJRGAITKHLCHK-UHFFFAOYSA-N	-2	1	378.381	2.673	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)N[C@@H]1CCCCCC[C@H]1C(=O)[O-]	ZINC000262992340	602052371	/nfs/dbraw/zinc/05/23/71/602052371.db2.gz	SRZYRYJEXUYHJT-NVXWUHKLSA-N	-2	1	398.463	2.635	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)c2cccnc12	ZINC000677234870	602321622	/nfs/dbraw/zinc/32/16/22/602321622.db2.gz	QOYMJUUQJYNDAT-UHFFFAOYSA-N	-2	1	376.365	2.882	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1F	ZINC000531631529	602321997	/nfs/dbraw/zinc/32/19/97/602321997.db2.gz	ZRIGIYUOJCJVNS-UHFFFAOYSA-N	-2	1	381.381	2.728	20	0		GFADML
O=C([O-])NCCOc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)c1	ZINC000740667473	602447841	/nfs/dbraw/zinc/44/78/41/602447841.db2.gz	JVQDGEKCAYXMOK-UHFFFAOYSA-N	-2	1	376.434	2.623	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCN3C(=O)[O-])c1	ZINC000739788807	602646043	/nfs/dbraw/zinc/64/60/43/602646043.db2.gz	PINGHEYLQUGFSM-UHFFFAOYSA-N	-2	1	390.417	2.705	20	0		GFADML
COC(=O)c1ccc(F)c(S(=O)(=O)[N-]c2cc(NC(=O)[O-])ccc2F)c1	ZINC000739785775	602653114	/nfs/dbraw/zinc/65/31/14/602653114.db2.gz	WMKUXPIFFWVCPI-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)cc1OC	ZINC000739932122	602655652	/nfs/dbraw/zinc/65/56/52/602655652.db2.gz	IUZPQVFIWPBHJV-UHFFFAOYSA-N	-2	1	380.422	2.614	20	0		GFADML
COc1cc([C@@H](C)NC(=O)c2ccc(NC(=O)[O-])cc2[O-])cc(OC)c1OC	ZINC000739850213	602848746	/nfs/dbraw/zinc/84/87/46/602848746.db2.gz	IPPDWLLZDXCIRH-SNVBAGLBSA-N	-2	1	390.392	2.999	20	0		GFADML
CC1CCN(C(=O)C2CCN(C(=O)c3ccc(NC(=O)[O-])cc3[O-])CC2)CC1	ZINC000739113858	602850493	/nfs/dbraw/zinc/85/04/93/602850493.db2.gz	RFMYTBYZEWXBNP-UHFFFAOYSA-N	-2	1	389.452	2.593	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c([O-])c1	ZINC000740700688	602852646	/nfs/dbraw/zinc/85/26/46/602852646.db2.gz	ZWAPWCUFUQOUPS-UHFFFAOYSA-N	-2	1	379.372	2.944	20	0		GFADML
CC(C)(C)OC(=O)N(CCNC(=O)c1ccc(NC(=O)[O-])cc1[O-])C1CC1	ZINC000738703320	602857982	/nfs/dbraw/zinc/85/79/82/602857982.db2.gz	DKTWHLIUHLKHDI-UHFFFAOYSA-N	-2	1	379.413	2.611	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c([O-])c1	ZINC000740698730	602863742	/nfs/dbraw/zinc/86/37/42/602863742.db2.gz	PMNHZNPFTHXAAA-CQSZACIVSA-N	-2	1	384.310	2.964	20	0		GFADML
O=C([O-])N1CCC[C@@H]1C[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F	ZINC000740520398	603086151	/nfs/dbraw/zinc/08/61/51/603086151.db2.gz	KQXOOROVNNUHDM-MRVPVSSYSA-N	-2	1	386.779	2.780	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc(OCCNC(=O)[O-])c2)cc(C)c1F	ZINC000830137898	603399300	/nfs/dbraw/zinc/39/93/00/603399300.db2.gz	HOYYJXCVROEPAV-UHFFFAOYSA-N	-2	1	382.413	2.890	20	0		GFADML
CSc1nc(C)c(CCC(=O)O[C@@H]2CCCC[C@@H]2CNC(=O)[O-])c(=O)[n-]1	ZINC000829777740	603466148	/nfs/dbraw/zinc/46/61/48/603466148.db2.gz	MCFQXQCKWQBELT-DGCLKSJQSA-N	-2	1	383.470	2.515	20	0		GFADML
Cc1cnn(-c2ccc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])nc3)cc2F)c1	ZINC000830645851	603818704	/nfs/dbraw/zinc/81/87/04/603818704.db2.gz	MAVCAUPYEIFUIP-UHFFFAOYSA-N	-2	1	391.384	2.606	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCCc2nc(-c3ccncc3)cs2)c([O-])c1	ZINC000832833041	603875769	/nfs/dbraw/zinc/87/57/69/603875769.db2.gz	GIMZGBCCUVKJGH-UHFFFAOYSA-N	-2	1	384.417	2.973	20	0		GFADML
C[C@@H](CN(C)C(=O)[O-])C(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000824880909	604095274	/nfs/dbraw/zinc/09/52/74/604095274.db2.gz	POSVUOCIYZYXMM-ZDUSSCGKSA-N	-2	1	391.449	2.672	20	0		GFADML
CCC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C(=O)OC)c2)c1	ZINC000828580580	604790404	/nfs/dbraw/zinc/79/04/04/604790404.db2.gz	OEBQRWLXEAELBG-UHFFFAOYSA-N	-2	1	391.401	2.565	20	0		GFADML
Cc1nnc(-c2cccc([N-]S(=O)(=O)c3ccc(/C=C\C(=O)[O-])cc3)c2)n1C	ZINC000833017768	604793057	/nfs/dbraw/zinc/79/30/57/604793057.db2.gz	IDVIMGUMUVBJLO-FLIBITNWSA-N	-2	1	398.444	2.689	20	0		GFADML
COC(=O)c1ccc(C(=O)[O-])c(S(=O)(=O)[N-]c2ccc(C3CC3)cc2)c1	ZINC000833715213	604861035	/nfs/dbraw/zinc/86/10/35/604861035.db2.gz	QFXQKNOIDROUKZ-UHFFFAOYSA-N	-2	1	375.402	2.850	20	0		GFADML
O=C([O-])c1cncc(NC(=O)c2ccc(S(=O)(=O)[N-]c3ccccc3)cc2)c1	ZINC000833341498	604906843	/nfs/dbraw/zinc/90/68/43/604906843.db2.gz	UTABXPJJVNEWIS-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
C[C@@H]1CCCN(c2nc([O-])c(CC(=O)Nc3ccsc3C(=O)[O-])s2)C1	ZINC000833615057	604999670	/nfs/dbraw/zinc/99/96/70/604999670.db2.gz	ZSMUAFQCGWAEDH-MWLCHTKSSA-N	-2	1	381.479	2.505	20	0		GFADML
CC(C)COC[C@H]([N-]S(=O)(=O)c1cccc(F)c1C(=O)[O-])c1ccco1	ZINC000833489703	605022790	/nfs/dbraw/zinc/02/27/90/605022790.db2.gz	YXGLBPUQASSLOD-ZDUSSCGKSA-N	-2	1	385.413	2.809	20	0		GFADML
CC(C)(C)Cc1cc([N-]S(=O)(=O)c2ccc(C3(C(=O)[O-])CC3)cc2)[nH]n1	ZINC000833429911	605134382	/nfs/dbraw/zinc/13/43/82/605134382.db2.gz	AGCDJAJLTNAAQE-UHFFFAOYSA-N	-2	1	377.466	2.915	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(Cl)cc2C(=O)[O-])ccc1F	ZINC000833398982	605167501	/nfs/dbraw/zinc/16/75/01/605167501.db2.gz	ZNZWGCSQFOGEDQ-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2C(=O)[O-])c1	ZINC000833656230	605168197	/nfs/dbraw/zinc/16/81/97/605168197.db2.gz	AGXXBALIVWZBDO-UHFFFAOYSA-N	-2	1	397.840	2.980	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)Nc2ccc(CN(C)C(=O)[O-])cc2)cc1C(=O)[O-]	ZINC000833744666	605169578	/nfs/dbraw/zinc/16/95/78/605169578.db2.gz	LWSFMJKVLOYWCW-UHFFFAOYSA-N	-2	1	396.396	2.743	20	0		GFADML
O=C([O-])N1CCCc2cc([N-]S(=O)(=O)c3ccc4c(c3)OCO4)ccc21	ZINC000834114383	605388936	/nfs/dbraw/zinc/38/89/36/605388936.db2.gz	BFCKYNUSILBNLC-UHFFFAOYSA-N	-2	1	376.390	2.647	20	0		GFADML
O=C([O-])NCCOc1ccc([N-]S(=O)(=O)c2cccc3ncccc32)cc1	ZINC000834244612	606080845	/nfs/dbraw/zinc/08/08/45/606080845.db2.gz	CAERKYWAVNSWTF-UHFFFAOYSA-N	-2	1	387.417	2.682	20	0		GFADML
CSCc1ccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(F)c2)cc1	ZINC000066588247	654908385	/nfs/dbraw/zinc/90/83/85/654908385.db2.gz	FKSSNQTTZQQDGK-UHFFFAOYSA-N	-2	1	385.438	2.953	20	0		GFADML
CC[C@@H](C)C(=O)[N-][N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F	ZINC000190727258	655394542	/nfs/dbraw/zinc/39/45/42/655394542.db2.gz	KXZQYYONINPLAK-ZCFIWIBFSA-N	-2	1	387.658	2.597	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2cccc(CC(=O)[O-])c2)c1Cl	ZINC000753778858	655858463	/nfs/dbraw/zinc/85/84/63/655858463.db2.gz	IGTQCPWOBLJTBO-UHFFFAOYSA-N	-2	1	383.809	2.775	20	0		GFADML
C[C@@H]1CCCC[C@@H]1OCC[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F	ZINC000761262535	656006005	/nfs/dbraw/zinc/00/60/05/656006005.db2.gz	FSFCUSPZUYITHJ-MFKMUULPSA-N	-2	1	377.409	2.537	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3nccnc3c2)cc(Cl)c1F	ZINC000767740753	656218382	/nfs/dbraw/zinc/21/83/82/656218382.db2.gz	XOGPPOPSXITKCG-UHFFFAOYSA-N	-2	1	381.772	2.921	20	0		GFADML
CS(=O)(=O)[N-]c1cc(F)ccc1NC(=O)c1ccc2[n-]c(=S)oc2c1	ZINC000774001524	656481686	/nfs/dbraw/zinc/48/16/86/656481686.db2.gz	PMBINNDDEBGUPS-UHFFFAOYSA-N	-2	1	381.410	2.879	20	0		GFADML
C[C@H](CC[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)C(=O)[O-]	ZINC000776590470	656764253	/nfs/dbraw/zinc/76/42/53/656764253.db2.gz	TXSGTZVCAQNVHZ-ZCFIWIBFSA-N	-2	1	388.642	2.631	20	0		GFADML
C[C@@H]1CC[C@@](C[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)(CC(=O)[O-])C1	ZINC000776626197	656770101	/nfs/dbraw/zinc/77/01/01/656770101.db2.gz	LLSWVBKKENEJHW-OTYXRUKQSA-N	-2	1	381.281	2.948	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccccc2[C@H](O)C(F)(F)F)cc1	ZINC000777744142	656833659	/nfs/dbraw/zinc/83/36/59/656833659.db2.gz	MIJJBUWPOQGRAS-ZDUSSCGKSA-N	-2	1	375.324	2.781	20	0		GFADML
COc1cc(S(=O)(=O)[N-][C@H](C2CC2)C(F)(F)F)c(Cl)cc1C(=O)[O-]	ZINC000871962937	662746899	/nfs/dbraw/zinc/74/68/99/662746899.db2.gz	JDQQYUXKWUPIBD-LLVKDONJSA-N	-2	1	387.763	2.666	20	0		GFADML
Cc1nc2ccc([N-]S(=O)(=O)c3ccc(OCC(=O)[O-])cc3)cc2s1	ZINC000047906692	551154111	/nfs/dbraw/zinc/15/41/11/551154111.db2.gz	PXWJWOSDMXYZKU-UHFFFAOYSA-N	-2	1	378.431	2.869	20	0		GFADML
Cc1csc([C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)C2CC2)n1	ZINC000185064699	552352864	/nfs/dbraw/zinc/35/28/64/552352864.db2.gz	VBXIPDSQKKZKSN-ZDUSSCGKSA-N	-2	1	388.417	2.858	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cn2cccn2)cc1	ZINC000327371536	563458146	/nfs/dbraw/zinc/45/81/46/563458146.db2.gz	ZNIUCERQZNYUCA-UHFFFAOYSA-N	-2	1	377.447	2.800	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(C)cc(C(=O)[O-])c2)cc1Cl	ZINC000507579743	564233400	/nfs/dbraw/zinc/23/34/00/564233400.db2.gz	ACLOPARZHNEYRI-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2)c(Br)c1	ZINC000475815044	564321082	/nfs/dbraw/zinc/32/10/82/564321082.db2.gz	MGNGAXVVGBLSHT-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)c(C)c(C(=O)[O-])c2)cc1	ZINC000479248429	564432902	/nfs/dbraw/zinc/43/29/02/564432902.db2.gz	GKOPFMDRCPPKEM-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)cc1C(=O)[O-]	ZINC000479249890	564432944	/nfs/dbraw/zinc/43/29/44/564432944.db2.gz	PHDMPPIQYPTKGA-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
O=C(N[C@H]1[C@@H]2CCC[C@@H]21)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000516134124	564494419	/nfs/dbraw/zinc/49/44/19/564494419.db2.gz	CFNBKILVELTHQX-ATCWAGBWSA-N	-2	1	378.475	2.783	20	0		GFADML
O=C([O-])[C@H](CCSc1ccccc1)[N-]S(=O)(=O)c1cccc(F)c1F	ZINC000516220891	564496826	/nfs/dbraw/zinc/49/68/26/564496826.db2.gz	FGYXAYDHJGEIKM-ZDUSSCGKSA-N	-2	1	387.429	2.879	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3csnn3)cc2)cc1	ZINC000481966211	564530164	/nfs/dbraw/zinc/53/01/64/564530164.db2.gz	GTUJODCTNLTIRO-UHFFFAOYSA-N	-2	1	375.431	2.633	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2C)cc1Cl	ZINC000548210839	564536522	/nfs/dbraw/zinc/53/65/22/564536522.db2.gz	NGNCMWXGVGKZTP-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)s1	ZINC000548221185	564538385	/nfs/dbraw/zinc/53/83/85/564538385.db2.gz	QDWRXWWVEQFEIJ-UHFFFAOYSA-N	-2	1	389.838	2.616	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl)C(F)F	ZINC000572043360	564578848	/nfs/dbraw/zinc/57/88/48/564578848.db2.gz	ZAORSULODSPYFJ-YFKPBYRVSA-N	-2	1	380.171	2.767	20	0		GFADML
O=C([O-])[C@H](O)[C@@H](CC1CCCCC1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000549549337	564597718	/nfs/dbraw/zinc/59/77/18/564597718.db2.gz	RGGPVSKRXBMOFJ-ZIAGYGMSSA-N	-2	1	393.864	2.542	20	0		GFADML
O=C([O-])c1cc(F)cc(S(=O)(=O)[N-]c2ccc(OCC(F)F)cc2)c1	ZINC000485258104	564610657	/nfs/dbraw/zinc/61/06/57/564610657.db2.gz	GIBNHGJFEKAJMF-UHFFFAOYSA-N	-2	1	375.324	2.969	20	0		GFADML
Cc1c(Cl)ccc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000618761872	565314290	/nfs/dbraw/zinc/31/42/90/565314290.db2.gz	PWQPBVXBMAYXEZ-UHFFFAOYSA-N	-2	1	381.797	2.729	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]CC[C@@H](CC(=O)[O-])C(F)(F)F)c(F)c1F	ZINC000629303958	565839165	/nfs/dbraw/zinc/83/91/65/565839165.db2.gz	PGZVHXZHZCOTJK-QMMMGPOBSA-N	-2	1	375.315	2.595	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2ccccc2CC(=O)[O-])c1	ZINC000818516961	597452570	/nfs/dbraw/zinc/45/25/70/597452570.db2.gz	IXTLAEGIFOMAFV-UHFFFAOYSA-N	-2	1	377.418	2.518	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(C(=O)N(C)[C@H](C)C(=O)[O-])c2)c1	ZINC000263296899	597465849	/nfs/dbraw/zinc/46/58/49/597465849.db2.gz	MORYDUSXAZMJAE-CQSZACIVSA-N	-2	1	390.461	2.649	20	0		GFADML
Cc1ccc(NC(=O)C(C)(C)NC(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1	ZINC000738617339	599733682	/nfs/dbraw/zinc/73/36/82/599733682.db2.gz	SMWWQEHPCFWYJE-UHFFFAOYSA-N	-2	1	391.449	2.781	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)Nc2ccc(CCC(=O)[O-])cc2)o1	ZINC000532009667	599769907	/nfs/dbraw/zinc/76/99/07/599769907.db2.gz	AZVJWYCVDGWUHC-UHFFFAOYSA-N	-2	1	394.449	2.626	20	0		GFADML
CC[C@@H](C)[C@@H](C)N(C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CC1	ZINC000736870247	599775052	/nfs/dbraw/zinc/77/50/52/599775052.db2.gz	KAXQKBQTAKKMIN-ZIAGYGMSSA-N	-2	1	385.464	2.832	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)c(C(=O)[O-])s1	ZINC000737681800	599814544	/nfs/dbraw/zinc/81/45/44/599814544.db2.gz	VFHNNNZKIUKBLK-UHFFFAOYSA-N	-2	1	393.801	2.826	20	0		GFADML
O=C([O-])c1c(F)cccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC(=O)N2	ZINC000364083122	599852022	/nfs/dbraw/zinc/85/20/22/599852022.db2.gz	LWEOTQSTEIWASA-UHFFFAOYSA-N	-2	1	378.381	2.600	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)c(C)c1	ZINC000477414745	599906889	/nfs/dbraw/zinc/90/68/89/599906889.db2.gz	GTRDXZKBGJCWTJ-UHFFFAOYSA-N	-2	1	376.434	2.552	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)ccc1C(=O)NC(C)C	ZINC000466294122	599908346	/nfs/dbraw/zinc/90/83/46/599908346.db2.gz	VOICYQPEQKYTCB-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
O=C([O-])CSCc1cccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)oc3c2)c1	ZINC000739873558	599927888	/nfs/dbraw/zinc/92/78/88/599927888.db2.gz	FZWASTNMJCYAQZ-UHFFFAOYSA-N	-2	1	394.430	2.652	20	0		GFADML
CCOC(=O)/C=C/c1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000737137471	600094426	/nfs/dbraw/zinc/09/44/26/600094426.db2.gz	VCNRXYGKFBILQB-BJMVGYQFSA-N	-2	1	393.392	2.901	20	0		GFADML
COC(=O)c1cc2cc([N-]S(=O)(=O)c3cc(F)ccc3C(=O)[O-])ccc2o1	ZINC000737677733	600095623	/nfs/dbraw/zinc/09/56/23/600095623.db2.gz	KIVJFJRQMFSPAY-UHFFFAOYSA-N	-2	1	393.348	2.858	20	0		GFADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)cc1	ZINC000739767050	600101758	/nfs/dbraw/zinc/10/17/58/600101758.db2.gz	QZXGXNOMRLRSNT-UHFFFAOYSA-N	-3	1	382.369	2.734	20	0		GFADML
O=C([O-])c1ccc2c(=O)[nH]c(CSc3nc(C(F)(F)F)cc(=O)[n-]3)nc2c1	ZINC000740187624	600120919	/nfs/dbraw/zinc/12/09/19/600120919.db2.gz	CDZNNMUNNPPHTQ-UHFFFAOYSA-N	-2	1	398.322	2.840	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ccccc1F)c1nc(-c2ccc(C(=O)[O-])cc2)no1	ZINC000736671807	600244868	/nfs/dbraw/zinc/24/48/68/600244868.db2.gz	YWNWHCUEMHNFLR-JTQLQIEISA-N	-2	1	391.380	2.613	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)ccc1F	ZINC000736160369	600256285	/nfs/dbraw/zinc/25/62/85/600256285.db2.gz	BNFRINOKQBRTEJ-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
Cc1ccc(C[C@@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)s1	ZINC000738588969	600414090	/nfs/dbraw/zinc/41/40/90/600414090.db2.gz	HWQKHJMQWZRUHX-GFCCVEGCSA-N	-2	1	399.472	2.524	20	0		GFADML
C[C@@H]1CCCC[C@@H]1CCNC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736777777	600424575	/nfs/dbraw/zinc/42/45/75/600424575.db2.gz	DGLXZDFJEGKOMU-HUUCEWRRSA-N	-2	1	385.464	2.739	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(N2CCCC2=O)c(F)c1	ZINC000483136021	600458088	/nfs/dbraw/zinc/45/80/88/600458088.db2.gz	CGCPBDOYFCZHKV-UHFFFAOYSA-N	-2	1	392.408	2.760	20	0		GFADML
CC(C)S(=O)(=O)Cc1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)c1	ZINC000487354556	600488531	/nfs/dbraw/zinc/48/85/31/600488531.db2.gz	MROLMKUAYNVMGS-UHFFFAOYSA-N	-2	1	397.474	2.509	20	0		GFADML
CC(C)C(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)c1	ZINC000481957430	600627090	/nfs/dbraw/zinc/62/70/90/600627090.db2.gz	LDZCHPOQHFDVSS-UHFFFAOYSA-N	-2	1	376.434	2.709	20	0		GFADML
CC[C@@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000267212741	600627574	/nfs/dbraw/zinc/62/75/74/600627574.db2.gz	SQDDSPVBRKXTMF-CYBMUJFWSA-N	-2	1	390.461	2.643	20	0		GFADML
Cc1nc(COc2ccc([N-]S(=O)(=O)c3csc(C(=O)[O-])c3)cc2)no1	ZINC000594578350	600680452	/nfs/dbraw/zinc/68/04/52/600680452.db2.gz	UOECRVNJDMTNQW-UHFFFAOYSA-N	-2	1	395.418	2.518	20	0		GFADML
Cc1noc(COc2ccc([N-]S(=O)(=O)c3csc(C(=O)[O-])c3)cc2)n1	ZINC000510168656	600681959	/nfs/dbraw/zinc/68/19/59/600681959.db2.gz	RWIDTTUADQLCAE-UHFFFAOYSA-N	-2	1	395.418	2.518	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(N3CCSCC3)cc2)cs1	ZINC000266110521	600684922	/nfs/dbraw/zinc/68/49/22/600684922.db2.gz	VWGCNRWLTKEHAI-UHFFFAOYSA-N	-2	1	384.504	2.800	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3)ccc1C(=O)[O-]	ZINC000831328670	600687808	/nfs/dbraw/zinc/68/78/08/600687808.db2.gz	XBICHSHXTULFJQ-UHFFFAOYSA-N	-2	1	389.429	2.851	20	0		GFADML
Cc1cc(F)cc(C(=O)[O-])c1[N-]S(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1	ZINC000738397605	600891982	/nfs/dbraw/zinc/89/19/82/600891982.db2.gz	UKOUMNBMRIEYTQ-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(C)(C)C(=O)[O-])cc1	ZINC000568699762	600900007	/nfs/dbraw/zinc/90/00/07/600900007.db2.gz	HGJVJDBRDDHYPL-UHFFFAOYSA-N	-3	1	377.418	2.856	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)c1	ZINC000267513502	601234279	/nfs/dbraw/zinc/23/42/79/601234279.db2.gz	KPVHTJZZARUKNM-UHFFFAOYSA-N	-2	1	379.434	2.530	20	0		GFADML
O=C([O-])c1ccccc1S(=O)(=O)[N-]c1ccc([S@@](=O)C(F)(F)F)cc1	ZINC000833335418	601251231	/nfs/dbraw/zinc/25/12/31/601251231.db2.gz	PTZJRWXLMLEDII-XMMPIXPASA-N	-2	1	393.364	2.813	20	0		GFADML
COC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1	ZINC000831198967	601325887	/nfs/dbraw/zinc/32/58/87/601325887.db2.gz	VEUKPKCJNDEPAZ-XGICHPGQSA-N	-2	1	390.417	2.788	20	0		GFADML
COC(=O)/C=C\c1ccc(S(=O)(=O)[N-]c2ccc(N(C)C(=O)[O-])cc2)cc1	ZINC000831124787	601325898	/nfs/dbraw/zinc/32/58/98/601325898.db2.gz	UNVGCTKZHJZRRI-XGICHPGQSA-N	-2	1	390.417	2.788	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(N(C)C(=O)[O-])cc2)ccc1F	ZINC000831348428	601325919	/nfs/dbraw/zinc/32/59/19/601325919.db2.gz	MGPIFOOFVCYCPH-UHFFFAOYSA-N	-2	1	382.369	2.527	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccc(C=CC(=O)[O-])cc3)c2)n[nH]1	ZINC000832992013	601326580	/nfs/dbraw/zinc/32/65/80/601326580.db2.gz	ZEOPGYLUCJVOMB-YFHOEESVSA-N	-2	1	384.417	2.679	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)ccc1Cl	ZINC000063443747	601326743	/nfs/dbraw/zinc/32/67/43/601326743.db2.gz	NVCYDXGXVRKASX-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])c1	ZINC000476420768	601329771	/nfs/dbraw/zinc/32/97/71/601329771.db2.gz	XJNAPAGJYYNAFT-UHFFFAOYSA-N	-2	1	381.381	2.728	20	0		GFADML
COC(=O)N(C)Cc1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000735268698	601331304	/nfs/dbraw/zinc/33/13/04/601331304.db2.gz	HIAXQZAPMBKQEP-UHFFFAOYSA-N	-2	1	396.396	2.523	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000829852931	601333098	/nfs/dbraw/zinc/33/30/98/601333098.db2.gz	VXFKRYLOEWDVFP-FLIBITNWSA-N	-2	1	389.429	2.691	20	0		GFADML
C/C(=C/COC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1)C(=O)[O-]	ZINC000825780946	601410292	/nfs/dbraw/zinc/41/02/92/601410292.db2.gz	LVMFNVRCPIBILI-RAXLEYEMSA-N	-2	1	375.402	2.675	20	0		GFADML
Cc1nnc(-c2ccc([N-]S(=O)(=O)c3cc(F)c(F)c(C(=O)[O-])c3)cc2)o1	ZINC000751143934	601483879	/nfs/dbraw/zinc/48/38/79/601483879.db2.gz	YXSJQESMUJTEHL-UHFFFAOYSA-N	-2	1	395.343	2.822	20	0		GFADML
Cc1cc(C)c(-c2cc([N-]S(=O)(=O)c3cc(C(=O)[O-])n(C)c3)n[nH]2)cc1C	ZINC000444416595	601603988	/nfs/dbraw/zinc/60/39/88/601603988.db2.gz	BNHDWYROLJTGLS-UHFFFAOYSA-N	-2	1	388.449	2.839	20	0		GFADML
CN(C)C(=O)c1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000025369049	601826587	/nfs/dbraw/zinc/82/65/87/601826587.db2.gz	MJPCFSNMZCXLBO-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000737763868	601830174	/nfs/dbraw/zinc/83/01/74/601830174.db2.gz	VZLUDHPQAWOIIB-UHFFFAOYSA-N	-2	1	397.836	2.945	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)CC3)ccc1Cl	ZINC000741653017	601830226	/nfs/dbraw/zinc/83/02/26/601830226.db2.gz	BLCZJUKXTMMOCQ-UHFFFAOYSA-N	-2	1	380.809	2.724	20	0		GFADML
Cc1cc(C(=O)NC(C)C)ccc1[N-]S(=O)(=O)c1cccc(F)c1C(=O)[O-]	ZINC000832863093	601859943	/nfs/dbraw/zinc/85/99/43/601859943.db2.gz	KRSGGXNKIBLUCH-UHFFFAOYSA-N	-2	1	394.424	2.771	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@H]2CCCCCC[C@H]2C(=O)[O-])c(=O)[n-]1	ZINC000832795296	601914585	/nfs/dbraw/zinc/91/45/85/601914585.db2.gz	YCHBXVFOHJAJQA-KGLIPLIRSA-N	-2	1	381.498	2.685	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)Nc1ccccc1NC(=O)[O-]	ZINC000740208473	602175156	/nfs/dbraw/zinc/17/51/56/602175156.db2.gz	QRLHAMLBINLTRQ-UHFFFAOYSA-N	-2	1	379.376	2.824	20	0		GFADML
O=C([O-])c1cc(Br)cc(S(=O)(=O)[N-]c2cc(C3CC3)n[nH]2)c1	ZINC000833294634	602306585	/nfs/dbraw/zinc/30/65/85/602306585.db2.gz	SGXSNLBFIJDYEK-UHFFFAOYSA-N	-2	1	386.227	2.549	20	0		GFADML
CN(CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1)C(=O)[O-]	ZINC000739628487	602568618	/nfs/dbraw/zinc/56/86/18/602568618.db2.gz	ZJKAWNOWBSURBA-UHFFFAOYSA-N	-2	1	397.840	2.689	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)c([O-])c1	ZINC000740697956	602856230	/nfs/dbraw/zinc/85/62/30/602856230.db2.gz	HRPDKVQJXZHWLQ-CQSZACIVSA-N	-2	1	384.310	2.964	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2cc(F)cc(N3CCOCC3)c2)c([O-])c1	ZINC000740700613	602857866	/nfs/dbraw/zinc/85/78/66/602857866.db2.gz	VAHZQTHRYPCLAQ-UHFFFAOYSA-N	-2	1	375.356	2.710	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@@H]2CCC[C@@H]2CNC(=O)[O-])c([O-])c1	ZINC000823827975	603909811	/nfs/dbraw/zinc/90/98/11/603909811.db2.gz	NFCJDMZGTNCPMS-BXUZGUMPSA-N	-2	1	393.440	2.905	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])cc1C(=O)[O-]	ZINC000830421255	604014805	/nfs/dbraw/zinc/01/48/05/604014805.db2.gz	NTZIIZKJKKLYMB-UHFFFAOYSA-N	-3	1	376.390	2.535	20	0		GFADML
CCCCC[C@@H]1CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829348517	604343266	/nfs/dbraw/zinc/34/32/66/604343266.db2.gz	SAZRMQOAKYPYQL-QGZVFWFLSA-N	-2	1	385.464	2.978	20	0		GFADML
CC(C)Oc1ccc(S(=O)(=O)[N-]c2ccc3[nH]nc(C(=O)[O-])c3c2)cc1	ZINC000833506518	605006201	/nfs/dbraw/zinc/00/62/01/605006201.db2.gz	GIBOWNFOLIDGSC-UHFFFAOYSA-N	-2	1	375.406	2.849	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)c([O-])c1	ZINC000834255285	605637923	/nfs/dbraw/zinc/63/79/23/605637923.db2.gz	HMYBPJMFAMABND-UHFFFAOYSA-N	-2	1	377.740	2.719	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCOC[C@H]2CC(=O)c2cccs2)c([O-])c1	ZINC000834259014	605655916	/nfs/dbraw/zinc/65/59/16/605655916.db2.gz	VIQWSSXNJIXSJO-GFCCVEGCSA-N	-2	1	390.417	2.658	20	0		GFADML
O=C([O-])NCc1nc(C(=O)[N-]c2nnc(/C=C/c3ccco3)s2)cs1	ZINC000834248974	605943546	/nfs/dbraw/zinc/94/35/46/605943546.db2.gz	LJCOKQTUINKICY-ONEGZZNKSA-N	-2	1	377.407	2.778	20	0		GFADML
O=C([O-])NCc1nc(C(=O)[N-]c2nnc(/C=C\c3ccco3)s2)cs1	ZINC000834248972	605943589	/nfs/dbraw/zinc/94/35/89/605943589.db2.gz	LJCOKQTUINKICY-ARJAWSKDSA-N	-2	1	377.407	2.778	20	0		GFADML
CC(=O)NCc1ccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])s1	ZINC000013269593	654503718	/nfs/dbraw/zinc/50/37/18/654503718.db2.gz	ZSWKQZMZOJJUNB-UHFFFAOYSA-N	-2	1	388.854	2.537	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]NC(=O)c2ccc(Cl)cc2[O-])c(Cl)c1	ZINC000055664881	654779841	/nfs/dbraw/zinc/77/98/41/654779841.db2.gz	PBYJLOCHWAGCPZ-UHFFFAOYSA-N	-2	1	375.233	2.631	20	0		GFADML
CSC[C@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000265574579	655486275	/nfs/dbraw/zinc/48/62/75/655486275.db2.gz	WPAVFQNMEGGCCB-JTQLQIEISA-N	-2	1	386.520	2.736	20	0		GFADML
Cc1c([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)cccc1C(=O)[O-]	ZINC000767741034	656218296	/nfs/dbraw/zinc/21/82/96/656218296.db2.gz	YWAUSJYNECSUOR-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
COc1cccc([C@H]([N-]S(=O)(=O)c2c(Cl)ccnc2Cl)C(=O)[O-])c1	ZINC000776520175	656750141	/nfs/dbraw/zinc/75/01/41/656750141.db2.gz	JBQDXPPZVFCELB-NSHDSACASA-N	-2	1	391.232	2.501	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)[C@@H](O)c1ccccc1	ZINC000776599831	656765264	/nfs/dbraw/zinc/76/52/64/656765264.db2.gz	HKGMCZNPKBYQPV-QWRGUYRKSA-N	-2	1	396.273	2.520	20	0		GFADML
CC[C@@H](C)C[C@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000776616671	656768298	/nfs/dbraw/zinc/76/82/98/656768298.db2.gz	VOKSOOWSJKXTNQ-APPZFPTMSA-N	-2	1	399.694	2.665	20	0		GFADML
Cc1nc(Cl)ccc1[N-]S(=O)(=O)c1ccc(OCC(=O)[O-])c(Cl)c1	ZINC000788495752	657731598	/nfs/dbraw/zinc/73/15/98/657731598.db2.gz	WZXYSYSJEPVSSV-UHFFFAOYSA-N	-2	1	391.232	2.961	20	0		GFADML
COc1cc(Cl)c(S(=O)(=O)[N-]c2ccc3c(c2)CCO3)cc1C(=O)[O-]	ZINC000790383394	657965415	/nfs/dbraw/zinc/96/54/15/657965415.db2.gz	KEVHAKBCRVTWJG-UHFFFAOYSA-N	-2	1	383.809	2.783	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@H]([N-]S(=O)(=O)c1ccc(F)c(F)c1F)CCS2	ZINC000899950096	663703925	/nfs/dbraw/zinc/70/39/25/663703925.db2.gz	WGIDPEQPVIHBJX-OSPBMLLASA-N	-2	1	395.424	2.511	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)[C@@H]1CCOC2(CCC2)C1	ZINC000372262908	563300660	/nfs/dbraw/zinc/30/06/60/563300660.db2.gz	TWCLRHBIHIONSJ-ZWNOBZJWSA-N	-2	1	391.848	2.560	20	0		GFADML
COc1cccc(S(=O)(=O)[N-]c2ccc(Br)cc2C(=O)[O-])c1	ZINC000317410160	563442217	/nfs/dbraw/zinc/44/22/17/563442217.db2.gz	DDXWLIANUIVVPO-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
O=C([O-])C[C@H](CC[N-]S(=O)(=O)c1cc(F)ccc1Cl)C(F)(F)F	ZINC000284981831	563498226	/nfs/dbraw/zinc/49/82/26/563498226.db2.gz	FXEIRHPEUZOAST-ZETCQYMHSA-N	-2	1	377.743	2.801	20	0		GFADML
CC(C)(C)OC[C@H]([N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl)C(=O)[O-]	ZINC000391954690	563526227	/nfs/dbraw/zinc/52/62/27/563526227.db2.gz	KASRNKKKLKIVSR-QMMMGPOBSA-N	-2	1	388.244	2.679	20	0		GFADML
O=C(N[C@H]1CCCSC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436571785	563674548	/nfs/dbraw/zinc/67/45/48/563674548.db2.gz	DUHOFQYJIUPOCW-LBPRGKRZSA-N	-2	1	398.531	2.880	20	0		GFADML
O=C([O-])c1ccc([O-])c(S(=O)(=O)Nc2ccc(Br)c(F)c2)c1	ZINC000436995556	563687900	/nfs/dbraw/zinc/68/79/00/563687900.db2.gz	QPUBMNCKEYSRMY-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
Cc1oc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(S[C@@H](C)C(=O)[O-])cc1	ZINC000507600055	564234526	/nfs/dbraw/zinc/23/45/26/564234526.db2.gz	BUKIFYPOFFXHQY-VIFPVBQESA-N	-2	1	385.419	2.652	20	0		GFADML
COc1cc(S(=O)(=O)Nc2ccccc2C(=O)[O-])c(Cl)cc1C(=O)[O-]	ZINC000542740812	564324046	/nfs/dbraw/zinc/32/40/46/564324046.db2.gz	UQGSELGYYVAMNH-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(Cl)cc1C(=O)[O-]	ZINC000543658593	564358103	/nfs/dbraw/zinc/35/81/03/564358103.db2.gz	QKNFSKDZOZCAEY-UHFFFAOYSA-N	-2	1	375.811	2.907	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2c(C)n[nH]c2C(F)F)c(Cl)cc1C(=O)[O-]	ZINC000543665379	564358378	/nfs/dbraw/zinc/35/83/78/564358378.db2.gz	YPFFUJHGCAMYLW-UHFFFAOYSA-N	-2	1	395.771	2.817	20	0		GFADML
CNC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)c(C)c(C(=O)[O-])c2)c1	ZINC000479264546	564433662	/nfs/dbraw/zinc/43/36/62/564433662.db2.gz	DPTWTPNJVXIDRT-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1cccc(CC(=O)[O-])c1	ZINC000569537565	564467535	/nfs/dbraw/zinc/46/75/35/564467535.db2.gz	JKBGLVKDEWWNMA-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)c1c(F)cccc1F	ZINC000547615007	564503167	/nfs/dbraw/zinc/50/31/67/564503167.db2.gz	JXTTVVJDEAOWJC-LBPRGKRZSA-N	-2	1	379.743	2.862	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)ccc1[O-]	ZINC000481446863	564512807	/nfs/dbraw/zinc/51/28/07/564512807.db2.gz	AREDVJYJHFTYJZ-UHFFFAOYSA-N	-2	1	384.797	2.503	20	0		GFADML
C[C@H](CC[N-]S(=O)(=O)c1cc(Br)sc1Cl)CC(=O)[O-]	ZINC000548231390	564539773	/nfs/dbraw/zinc/53/97/73/564539773.db2.gz	FKIXPVYPUKYRFM-ZCFIWIBFSA-N	-2	1	390.708	2.943	20	0		GFADML
Cc1ccc([N-]S(C)(=O)=O)c(C(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000485462755	564616125	/nfs/dbraw/zinc/61/61/25/564616125.db2.gz	NOSIYAQXMJEYDT-UHFFFAOYSA-N	-2	1	382.825	2.970	20	0		GFADML
CC[C@H](C)Oc1cc(C)ccc1C[N-]S(=O)(=O)c1csnc1C(=O)[O-]	ZINC000580831147	564775296	/nfs/dbraw/zinc/77/52/96/564775296.db2.gz	FGXFUCSCTRAPRS-NSHDSACASA-N	-2	1	384.479	2.806	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C[C@H](C)C(=O)[O-])cc1	ZINC000558460130	564901692	/nfs/dbraw/zinc/90/16/92/564901692.db2.gz	ZQVOGYLHMDXVRQ-VIFPVBQESA-N	-3	1	383.447	2.819	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CCCC(=O)[O-])cc1	ZINC000535401703	565012350	/nfs/dbraw/zinc/01/23/50/565012350.db2.gz	RJOJDJZEXMWCFX-UHFFFAOYSA-N	-3	1	383.447	2.963	20	0		GFADML
O=C([O-])c1cc(Br)cc(S(=O)(=O)[N-]c2ccc3c(c2)CCO3)c1	ZINC000536498437	565038560	/nfs/dbraw/zinc/03/85/60/565038560.db2.gz	QPFHKGCBKUTJLN-UHFFFAOYSA-N	-2	1	398.234	2.883	20	0		GFADML
CCOC(=O)c1c[n-]c(NC(=O)c2cc(Cl)cc(Br)c2[O-])n1	ZINC000590355513	565185736	/nfs/dbraw/zinc/18/57/36/565185736.db2.gz	SZPVQCSMOBUYFF-UHFFFAOYSA-N	-2	1	388.605	2.960	20	0		GFADML
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)[N-]c1cc(F)c(F)cc1F	ZINC000591683574	565236474	/nfs/dbraw/zinc/23/64/74/565236474.db2.gz	LUFIYJGFCLTVKH-UHFFFAOYSA-N	-2	1	375.324	2.540	20	0		GFADML
C[C@H](CSCC[N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000592447921	565276548	/nfs/dbraw/zinc/27/65/48/565276548.db2.gz	IEBCHBHVQVMDHN-ZCFIWIBFSA-N	-2	1	378.324	2.787	20	0		GFADML
O=C([O-])CC[C@@H](C[N-]S(=O)(=O)c1cc(F)ccc1Cl)C(F)(F)F	ZINC000663294504	565408937	/nfs/dbraw/zinc/40/89/37/565408937.db2.gz	SUQBUTXHSYRGSV-ZETCQYMHSA-N	-2	1	377.743	2.801	20	0		GFADML
O=C([O-])[C@H](CC1CCCCC1)[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000646043102	565585134	/nfs/dbraw/zinc/58/51/34/565585134.db2.gz	DTFAGFVVRWSJOB-LBPRGKRZSA-N	-2	1	380.388	2.802	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCC[C@H]2C[C@H]21	ZINC000672135087	565794998	/nfs/dbraw/zinc/79/49/98/565794998.db2.gz	SAZDAANSILDRRP-SMDDNHRTSA-N	-2	1	378.475	2.879	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(O[C@@H]2CCOC2)cc1	ZINC000606827050	565970804	/nfs/dbraw/zinc/97/08/04/565970804.db2.gz	PUWUTDZHAWHVDC-CYBMUJFWSA-N	-2	1	383.447	2.723	20	0		GFADML
COc1cc(OC)c([N-]S(=O)(=O)C[C@@H]2CCCC2(F)F)c(C(=O)[O-])c1	ZINC000654768107	566020732	/nfs/dbraw/zinc/02/07/32/566020732.db2.gz	KACKHFQMVAJXHL-VIFPVBQESA-N	-2	1	379.381	2.579	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)N(C)CCC(=O)[O-])cc2)cc1C	ZINC000262850822	597010501	/nfs/dbraw/zinc/01/05/01/597010501.db2.gz	GDSGITQQBVMPIK-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)NC[C@H](C)C(=O)[O-])c2)c1	ZINC000262479678	599778130	/nfs/dbraw/zinc/77/81/30/599778130.db2.gz	DBVBBIDMRQMSTJ-AWEZNQCLSA-N	-2	1	390.461	2.555	20	0		GFADML
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)cc1	ZINC000737154745	599853536	/nfs/dbraw/zinc/85/35/36/599853536.db2.gz	AIKZTIZTVSOGNF-UHFFFAOYSA-N	-2	1	377.418	2.681	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])ccc1C(=O)NC(C)C	ZINC000738463498	599908715	/nfs/dbraw/zinc/90/87/15/599908715.db2.gz	IEVMSPJXXXSADF-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(CSCC(=O)[O-])c2)c1	ZINC000737713924	599926507	/nfs/dbraw/zinc/92/65/07/599926507.db2.gz	PDEWPRDNHNIMST-UHFFFAOYSA-N	-2	1	395.458	2.592	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2cc(OC)c(OC)cc2C)c1	ZINC000511698526	600006109	/nfs/dbraw/zinc/00/61/09/600006109.db2.gz	BLCKUNPRTFSZTL-UHFFFAOYSA-N	-2	1	381.406	2.520	20	0		GFADML
C=C(C)COc1cccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])cc2)c1	ZINC000066587711	600098964	/nfs/dbraw/zinc/09/89/64/600098964.db2.gz	VTVWHIWQZNBPPU-UHFFFAOYSA-N	-2	1	377.418	2.906	20	0		GFADML
COc1cccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2N2CCCC2)c1	ZINC000738109526	600105655	/nfs/dbraw/zinc/10/56/55/600105655.db2.gz	RZHFHGLULHPDTD-UHFFFAOYSA-N	-2	1	376.434	2.794	20	0		GFADML
CSc1nc(C)c(CCC(=O)Oc2ccc(C(=O)[O-])cc2C(C)=O)c(=O)[n-]1	ZINC000738210151	600124703	/nfs/dbraw/zinc/12/47/03/600124703.db2.gz	QIZCBIOAXVYYOJ-UHFFFAOYSA-N	-2	1	390.417	2.652	20	0		GFADML
CC(C)(O)COc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000736344202	600245886	/nfs/dbraw/zinc/24/58/86/600245886.db2.gz	VMNHDLYPMGQZMG-UHFFFAOYSA-N	-2	1	399.852	2.989	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2cccc(C(=O)NC3CC3)c2)cc1Cl	ZINC000520502328	600483274	/nfs/dbraw/zinc/48/32/74/600483274.db2.gz	INGXZRQQOWERPX-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
CC(C)CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000267199054	600626206	/nfs/dbraw/zinc/62/62/06/600626206.db2.gz	PZEVEHKBRQGMEB-UHFFFAOYSA-N	-2	1	390.461	2.500	20	0		GFADML
Cc1nccc(-c2cccc([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)c2)n1	ZINC000378001348	600626308	/nfs/dbraw/zinc/62/63/08/600626308.db2.gz	NMJVXJPUYIBAJB-UHFFFAOYSA-N	-2	1	383.429	2.880	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(OC)c(C)c2C)cc1C(=O)[O-]	ZINC000831435116	600689970	/nfs/dbraw/zinc/68/99/70/600689970.db2.gz	PEMRSGOETMNJAC-UHFFFAOYSA-N	-2	1	393.417	2.598	20	0		GFADML
Cc1ccc(N2CCOC2=O)cc1[N-]S(=O)(=O)c1cccc(C)c1C(=O)[O-]	ZINC000832939674	600691742	/nfs/dbraw/zinc/69/17/42/600691742.db2.gz	SKLLUDIYUOYYOT-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
CC(C)(CC(=O)[O-])NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000736311535	600789920	/nfs/dbraw/zinc/78/99/20/600789920.db2.gz	XAUAHVFEKIYHEU-UHFFFAOYSA-N	-2	1	394.424	2.610	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])n(C)c2)ccc1OCC(F)(F)F	ZINC000606343407	600816501	/nfs/dbraw/zinc/81/65/01/600816501.db2.gz	YPEMZKYTTKZLBK-UHFFFAOYSA-N	-2	1	392.355	2.774	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)NCC(C)C)cc2)ccc1C(=O)[O-]	ZINC000506717130	600889834	/nfs/dbraw/zinc/88/98/34/600889834.db2.gz	AKFHRVMADODMQO-UHFFFAOYSA-N	-2	1	390.461	2.880	20	0		GFADML
CCCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)cc1	ZINC000506630057	600890084	/nfs/dbraw/zinc/89/00/84/600890084.db2.gz	BOSCDJFRHCHDNY-UHFFFAOYSA-N	-2	1	376.434	2.634	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)ccc1C(=O)N(C)C	ZINC000738463862	600894842	/nfs/dbraw/zinc/89/48/42/600894842.db2.gz	YJCMBUXXEQDSNU-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)c2)n[nH]1	ZINC000749009926	601205374	/nfs/dbraw/zinc/20/53/74/601205374.db2.gz	BHSAORSVJGFHQO-UHFFFAOYSA-N	-2	1	390.396	2.727	20	0		GFADML
COC[C@@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000831584005	601266472	/nfs/dbraw/zinc/26/64/72/601266472.db2.gz	CAEGZJALQWXZHD-GFCCVEGCSA-N	-2	1	390.672	2.805	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)ccc1F	ZINC000825890869	601320515	/nfs/dbraw/zinc/32/05/15/601320515.db2.gz	ZPDCAXJJTCBVLV-WTKPLQERSA-N	-2	1	378.381	2.683	20	0		GFADML
CC(C)n1ncc2cc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)cnc21	ZINC000032098001	601321969	/nfs/dbraw/zinc/32/19/69/601321969.db2.gz	AOJARKTYKYDOFX-UHFFFAOYSA-N	-2	1	378.385	2.650	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000736064456	601332377	/nfs/dbraw/zinc/33/23/77/601332377.db2.gz	IXVXDVBJIFEHJN-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(C(C)(C)C(=O)[O-])cc1	ZINC000524813962	601332391	/nfs/dbraw/zinc/33/23/91/601332391.db2.gz	KZDOOOLMBLZIPC-UHFFFAOYSA-N	-2	1	393.417	2.556	20	0		GFADML
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)[N-]c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000484815861	601334439	/nfs/dbraw/zinc/33/44/39/601334439.db2.gz	ZGZHCPZORLSWBV-UHFFFAOYSA-N	-2	1	397.474	2.514	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)CCC3)cc1C(=O)[O-]	ZINC000425981104	601387998	/nfs/dbraw/zinc/38/79/98/601387998.db2.gz	PQQPNRFXNUDTOG-UHFFFAOYSA-N	-2	1	375.402	2.713	20	0		GFADML
CCCC[C@@H](NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CCC1	ZINC000829295838	601720220	/nfs/dbraw/zinc/72/02/20/601720220.db2.gz	LHKZTOXPQDGIHL-GOSISDBHSA-N	-2	1	385.464	2.881	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)OCc1ccc(C(=O)[O-])c(F)c1	ZINC000833003970	601726103	/nfs/dbraw/zinc/72/61/03/601726103.db2.gz	DIXADIZAWRPRAL-UHFFFAOYSA-N	-2	1	387.367	2.565	20	0		GFADML
CC[C@H](NC(=O)c1cc(S(=O)(=O)[N-]c2ccccc2C)ccc1C)C(=O)[O-]	ZINC000262930009	601753423	/nfs/dbraw/zinc/75/34/23/601753423.db2.gz	GEVHPZLMUITQKC-INIZCTEOSA-N	-2	1	390.461	2.697	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3ccc(C)c(C(=O)[O-])c3)ccc2o1	ZINC000831795663	601795167	/nfs/dbraw/zinc/79/51/67/601795167.db2.gz	DHZWELJPOIZRMI-UHFFFAOYSA-N	-2	1	390.417	2.824	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(OC)cc2C(=O)[O-])ccc1Cl	ZINC000758161940	601828872	/nfs/dbraw/zinc/82/88/72/601828872.db2.gz	AMGBNLJFOSVPED-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
Cc1cc(C)c(-c2cc([N-]S(=O)(=O)c3csnc3C(=O)[O-])[nH]n2)cc1C	ZINC000832874953	601831753	/nfs/dbraw/zinc/83/17/53/601831753.db2.gz	QVNKNLSTQURDFE-UHFFFAOYSA-N	-2	1	392.462	2.957	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(N3CCCC3=O)c2)cc(F)c1F	ZINC000751145739	601832111	/nfs/dbraw/zinc/83/21/11/601832111.db2.gz	HKZFLHXGCUVOHW-UHFFFAOYSA-N	-2	1	396.371	2.591	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1C	ZINC000751145056	601833370	/nfs/dbraw/zinc/83/33/70/601833370.db2.gz	ANQVPBZOPWMQNP-UHFFFAOYSA-N	-2	1	384.360	2.731	20	0		GFADML
CCN(CC)C(=O)c1ccc(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)cc1	ZINC000462104580	601986877	/nfs/dbraw/zinc/98/68/77/601986877.db2.gz	RNAVMNVLNKFEQJ-UHFFFAOYSA-N	-2	1	390.461	2.597	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1sccc1Br)[C@H]1CCCN(C(=O)[O-])C1	ZINC000739036344	601991600	/nfs/dbraw/zinc/99/16/00/601991600.db2.gz	DJFXVORAJLHMQY-BDAKNGLRSA-N	-2	1	397.316	2.567	20	0		GFADML
CC(C)c1cccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])cc(S(C)(=O)=O)c2)c1	ZINC000476405405	602122486	/nfs/dbraw/zinc/12/24/86/602122486.db2.gz	AWFQWGAJJVKOLT-UHFFFAOYSA-N	-2	1	397.474	2.713	20	0		GFADML
CCC[C@@](C)(NC(=O)[O-])C(=O)OCc1cc(=O)oc2cc([O-])c(CC)cc12	ZINC000739299696	602285202	/nfs/dbraw/zinc/28/52/02/602285202.db2.gz	XANXBJXJIPCDDZ-LJQANCHMSA-N	-2	1	377.393	2.931	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1cccc(C(=O)CCC(=O)[O-])c1	ZINC000477418564	602308829	/nfs/dbraw/zinc/30/88/29/602308829.db2.gz	JRZBSVSLAKZEMD-UHFFFAOYSA-N	-3	1	391.401	2.542	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1cccc(CNC(=O)[O-])c1	ZINC000739375718	602515361	/nfs/dbraw/zinc/51/53/61/602515361.db2.gz	GOKVYUDKSSESRM-UHFFFAOYSA-N	-2	1	391.449	2.858	20	0		GFADML
COc1cc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])ccc1N1CCCC1=O	ZINC000739865181	602845312	/nfs/dbraw/zinc/84/53/12/602845312.db2.gz	DOTHAQSDDPACEY-UHFFFAOYSA-N	-2	1	385.376	2.870	20	0		GFADML
CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])c1	ZINC000739250557	602850326	/nfs/dbraw/zinc/85/03/26/602850326.db2.gz	RGYIWSBBMKSMOI-GFCCVEGCSA-N	-2	1	385.420	2.940	20	0		GFADML
COc1ccc(-n2ccc(CNC(=O)c3ccc(NC(=O)[O-])cc3[O-])n2)cc1	ZINC000739885512	602852549	/nfs/dbraw/zinc/85/25/49/602852549.db2.gz	YQSNXYYDGAHEHX-UHFFFAOYSA-N	-2	1	382.376	2.606	20	0		GFADML
CC(C)(C)OC(=O)N1CCC(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000738711262	602856225	/nfs/dbraw/zinc/85/62/25/602856225.db2.gz	YWPIVZUIVPMUSG-UHFFFAOYSA-N	-2	1	393.440	2.859	20	0		GFADML
CC(C)[C@@H](CNC(=O)c1ccc(NC(=O)[O-])cc1[O-])NC(=O)OC(C)(C)C	ZINC000738791225	602864259	/nfs/dbraw/zinc/86/42/59/602864259.db2.gz	SSUNVMJAGNLNKG-CYBMUJFWSA-N	-2	1	381.429	2.761	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C[C@@H](C)N1C(=O)OC(C)(C)C	ZINC000739169507	602864448	/nfs/dbraw/zinc/86/44/48/602864448.db2.gz	QDPSSRWAVDBOCA-VXGBXAGGSA-N	-2	1	393.440	2.952	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCN(c3nc4ccccc4o3)CC2)c([O-])c1	ZINC000740697681	602868532	/nfs/dbraw/zinc/86/85/32/602868532.db2.gz	HCDYDQQQKLTGOP-UHFFFAOYSA-N	-2	1	382.376	2.586	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])c(C)c1	ZINC000828789141	604014288	/nfs/dbraw/zinc/01/42/88/604014288.db2.gz	QDZQWVDPJAEGBR-UHFFFAOYSA-N	-2	1	390.417	2.623	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)OCc1ccc(C(=O)[O-])cc1F	ZINC000833665644	604700961	/nfs/dbraw/zinc/70/09/61/604700961.db2.gz	LKANJNHTUNRWCB-UHFFFAOYSA-N	-2	1	381.381	2.643	20	0		GFADML
CC(C)OC[C@H](C(=O)[O-])N(C)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-]	ZINC000833504276	604732582	/nfs/dbraw/zinc/73/25/82/604732582.db2.gz	AXHBEBBCKNRFFB-CQSZACIVSA-N	-2	1	396.440	2.689	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2[nH]nc(C)c2-c2ccccc2)cc1C(=O)[O-]	ZINC000833734438	604757328	/nfs/dbraw/zinc/75/73/28/604757328.db2.gz	DWRIPUOUMSQTCY-UHFFFAOYSA-N	-2	1	387.417	2.893	20	0		GFADML
O=C([O-])c1ccc(Cl)c(S(=O)(=O)[N-]c2ncccc2Br)c1	ZINC000091272169	604796642	/nfs/dbraw/zinc/79/66/42/604796642.db2.gz	ZQIKHHXSTSRKGI-UHFFFAOYSA-N	-2	1	391.630	2.997	20	0		GFADML
Cc1ccc(-c2n[nH]c([N-]S(=O)(=O)c3ccc(OCC(=O)[O-])cc3)c2C)o1	ZINC000433598500	604808119	/nfs/dbraw/zinc/80/81/19/604808119.db2.gz	FYJWKJULNKAHGS-UHFFFAOYSA-N	-2	1	391.405	2.551	20	0		GFADML
CC(C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000438803500	604990819	/nfs/dbraw/zinc/99/08/19/604990819.db2.gz	YNYBHENLEPATIL-UHFFFAOYSA-N	-2	1	396.852	2.977	20	0		GFADML
COC(=O)c1ccc(C(=O)[O-])c(S(=O)(=O)[N-]c2ccc3ncccc3c2)c1	ZINC000833714628	605008732	/nfs/dbraw/zinc/00/87/32/605008732.db2.gz	IGEGLVKLGJEUPB-UHFFFAOYSA-N	-2	1	386.385	2.520	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(C3(C(=O)[O-])CC3)cc2)cc1OC	ZINC000833733538	605124870	/nfs/dbraw/zinc/12/48/70/605124870.db2.gz	SZGTXZNUCWMXCY-UHFFFAOYSA-N	-2	1	377.418	2.621	20	0		GFADML
CCOC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000749142256	605160994	/nfs/dbraw/zinc/16/09/94/605160994.db2.gz	LKNUVRZDNGLPOY-UHFFFAOYSA-N	-2	1	396.396	2.917	20	0		GFADML
O=C([O-])CCOc1ccc(S(=O)(=O)[N-]c2cnc3c(c2)CCCC3)cc1	ZINC000833775002	605177517	/nfs/dbraw/zinc/17/75/17/605177517.db2.gz	RHIYCELGJOQZPV-UHFFFAOYSA-N	-2	1	376.434	2.615	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)OCc1cccc(NC(=O)[O-])c1	ZINC000827480239	605544591	/nfs/dbraw/zinc/54/45/91/605544591.db2.gz	IXHXUYMZGMEPBN-UHFFFAOYSA-N	-2	1	378.406	2.895	20	0		GFADML
Cn1ccnc1[C@@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1cccc(F)c1	ZINC000833956169	605627610	/nfs/dbraw/zinc/62/76/10/605627610.db2.gz	XNYUVSMPTGAWDS-INIZCTEOSA-N	-2	1	384.367	2.874	20	0		GFADML
O=C([O-])NCCCOC1CCN(C(=O)c2ccc(C(F)(F)F)cc2[O-])CC1	ZINC000834239030	606020370	/nfs/dbraw/zinc/02/03/70/606020370.db2.gz	WHQOCXCZPABQEV-UHFFFAOYSA-N	-2	1	390.358	2.690	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)cc1Cl	ZINC000822267240	606622625	/nfs/dbraw/zinc/62/26/25/606622625.db2.gz	PLLFCKMAFGXPMZ-UHFFFAOYSA-N	-2	1	395.876	2.581	20	0		GFADML
COc1ccc(-c2nc(SC/C=C\Cl)[n-]c(=O)c2-c2nnn[n-]2)cc1	ZINC000821733031	607160636	/nfs/dbraw/zinc/16/06/36/607160636.db2.gz	YLOUNGDYRADPKC-UQCOIBPSSA-N	-2	1	376.829	2.883	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cl)c(C(N)=O)c1	ZINC000042794024	654644712	/nfs/dbraw/zinc/64/47/12/654644712.db2.gz	QDKZGRHHUJOUTN-UHFFFAOYSA-N	-2	1	382.825	2.500	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)Nc1cc(F)c(C(=O)[O-])c(F)c1	ZINC000742232344	655712634	/nfs/dbraw/zinc/71/26/34/655712634.db2.gz	QWKRURBOEBFQME-UHFFFAOYSA-N	-2	1	377.346	2.532	20	0		GFADML
C[C@@]1(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)CC1(Cl)Cl	ZINC000840894384	661201462	/nfs/dbraw/zinc/20/14/62/661201462.db2.gz	SFDUXQPTCILLJF-GFCCVEGCSA-N	-2	1	388.219	2.915	20	0		GFADML
C[S@@](=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)c1	ZINC000767736253	656217597	/nfs/dbraw/zinc/21/75/97/656217597.db2.gz	IAVAYTNLTGBBKT-HSZRJFAPSA-N	-2	1	391.829	2.716	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(N3CCC3=O)c2)ccc1Cl	ZINC000790351033	657957052	/nfs/dbraw/zinc/95/70/52/657957052.db2.gz	BDYSKZSZJJZQNQ-UHFFFAOYSA-N	-2	1	380.809	2.576	20	0		GFADML
O=C([O-])C[C@@H]1COCC[C@@H]1[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000899948489	663703498	/nfs/dbraw/zinc/70/34/98/663703498.db2.gz	FPJRZWTXKPFNGQ-KOLCDFICSA-N	-2	1	389.882	2.713	20	0		GFADML
Cn1nc([N-]S(=O)(=O)c2c([O-])cccc2OC(F)(F)F)cc1C1CC1	ZINC000901929011	663751201	/nfs/dbraw/zinc/75/12/01/663751201.db2.gz	PRWRHMWMMYUNEQ-UHFFFAOYSA-N	-2	1	377.344	2.703	20	0		GFADML
COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)[N-]CCC(C)(C)C(=O)[O-]	ZINC000424385269	563377153	/nfs/dbraw/zinc/37/71/53/563377153.db2.gz	CQHOKOFWCOXVJI-UHFFFAOYSA-N	-2	1	398.264	2.559	20	0		GFADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000326982974	563456603	/nfs/dbraw/zinc/45/66/03/563456603.db2.gz	KPUUOUPNQSLTKB-UHFFFAOYSA-N	-3	1	383.809	2.856	20	0		GFADML
C[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])C(F)(F)F	ZINC000436734566	563678815	/nfs/dbraw/zinc/67/88/15/563678815.db2.gz	ASTFYKYDVVAQRB-QMMMGPOBSA-N	-2	1	394.396	2.935	20	0		GFADML
COC(=O)Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000438805033	563711264	/nfs/dbraw/zinc/71/12/64/563711264.db2.gz	ZHVKAQCVTUCAPN-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
CSCc1ccccc1[N-]S(=O)(=O)c1ccc(OCC(=O)[O-])c(F)c1	ZINC000545366418	564419975	/nfs/dbraw/zinc/41/99/75/564419975.db2.gz	LMBTZTBVFCRDSW-UHFFFAOYSA-N	-2	1	385.438	2.953	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2C)ccc1C(N)=O	ZINC000479384419	564438431	/nfs/dbraw/zinc/43/84/31/564438431.db2.gz	FNQKNOZUXAOZJN-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1C[S@@](C)=O	ZINC000546538916	564458114	/nfs/dbraw/zinc/45/81/14/564458114.db2.gz	RFIWDXDIEQCOBZ-XMMPIXPASA-N	-2	1	381.475	2.627	20	0		GFADML
O=C(N[C@@H]1[C@@H]2CCC[C@@H]21)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000516134125	564493889	/nfs/dbraw/zinc/49/38/89/564493889.db2.gz	CFNBKILVELTHQX-DRXBFXEBSA-N	-2	1	378.475	2.783	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cccc(F)c1F)Cc1cccc(Cl)c1	ZINC000547873540	564514846	/nfs/dbraw/zinc/51/48/46/564514846.db2.gz	MRBPVSNSVIYURF-NSHDSACASA-N	-2	1	389.807	2.840	20	0		GFADML
CC(C)[C@@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000516902281	564516368	/nfs/dbraw/zinc/51/63/68/564516368.db2.gz	JBIRZAYQWSMZEH-SNVBAGLBSA-N	-2	1	386.214	2.505	20	0		GFADML
Cc1ncsc1CCS(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1OC(C)C	ZINC000517573389	564536500	/nfs/dbraw/zinc/53/65/00/564536500.db2.gz	RUYSESKXALFFPV-UHFFFAOYSA-N	-2	1	384.479	2.921	20	0		GFADML
CCCSC[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000548250463	564543568	/nfs/dbraw/zinc/54/35/68/564543568.db2.gz	YVVRIKZZQLJICD-LURJTMIESA-N	-2	1	378.324	2.930	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl)C(=O)[O-]	ZINC000485223815	564610832	/nfs/dbraw/zinc/61/08/32/564610832.db2.gz	XSHGGCDPDYBPRV-BYPYZUCNSA-N	-2	1	377.043	2.507	20	0		GFADML
O=C([O-])c1cc(F)cc([N-]S(=O)(=O)c2cccnc2C(F)(F)F)c1F	ZINC000554533577	564764667	/nfs/dbraw/zinc/76/46/67/564764667.db2.gz	PSTQMWSNGDDNHA-UHFFFAOYSA-N	-2	1	382.266	2.878	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)[C@@H](C)C(=O)[O-]	ZINC000556702384	564836264	/nfs/dbraw/zinc/83/62/64/564836264.db2.gz	CLHSMPQZPDVVMY-RFZPGFLSSA-N	-2	1	376.681	2.552	20	0		GFADML
CSc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2[N-]S(C)(=O)=O)cc1	ZINC000611338602	566126382	/nfs/dbraw/zinc/12/63/82/566126382.db2.gz	OWTVTJVBPAKBNP-UHFFFAOYSA-N	-2	1	390.483	2.720	20	0		GFADML
O=C([O-])c1ccc(CNC(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)cc1	ZINC000666551506	597229689	/nfs/dbraw/zinc/22/96/89/597229689.db2.gz	GMVGTBGZCZEANA-UHFFFAOYSA-N	-2	1	382.416	2.895	20	0		GFADML
O=C([O-])CSCC(=O)OCc1nc(=O)c2c(-c3ccccc3)csc2[n-]1	ZINC000819543131	597452956	/nfs/dbraw/zinc/45/29/56/597452956.db2.gz	JPKVZETUNJVHTJ-UHFFFAOYSA-N	-2	1	390.442	2.925	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N(C)[C@@H](C)C(=O)[O-])cc2)cc1C	ZINC000263337308	597460329	/nfs/dbraw/zinc/46/03/29/597460329.db2.gz	WQMCNMHKMYKQDR-AWEZNQCLSA-N	-2	1	390.461	2.649	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)N(C)[C@@H](C)C(=O)[O-])c1	ZINC000262907932	597465739	/nfs/dbraw/zinc/46/57/39/597465739.db2.gz	RKUHKKRAVQWKPD-AWEZNQCLSA-N	-2	1	390.461	2.649	20	0		GFADML
CC(C)[C@@H](NC(=O)[O-])C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000736381415	599843409	/nfs/dbraw/zinc/84/34/09/599843409.db2.gz	LICQPYQLXFMEMR-MRXNPFEDSA-N	-2	1	391.449	2.718	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(C(=O)N2CCCC2)cc1	ZINC000268618047	599905860	/nfs/dbraw/zinc/90/58/60/599905860.db2.gz	MVWRWUGOGRKJQG-UHFFFAOYSA-N	-2	1	388.445	2.730	20	0		GFADML
CCC[C@@](C)([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000736960725	599981195	/nfs/dbraw/zinc/98/11/95/599981195.db2.gz	YLTWBSDUORHXSH-GFCCVEGCSA-N	-2	1	386.214	2.649	20	0		GFADML
O=C([O-])[C@@H]1C[C@@H]1C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1	ZINC000485468878	600102303	/nfs/dbraw/zinc/10/23/03/600102303.db2.gz	VILMLPAYAJGVRZ-LSDHHAIUSA-N	-2	1	394.836	2.800	20	0		GFADML
Cc1cc(C)cc([C@@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000738363594	600154689	/nfs/dbraw/zinc/15/46/89/600154689.db2.gz	KMLLSVXSRFINFO-OAHLLOKOSA-N	-2	1	393.443	2.901	20	0		GFADML
Cc1cccc(S(=O)(=O)[N-]c2cccc(C[S@](C)=O)c2C)c1C(=O)[O-]	ZINC000738746432	600254936	/nfs/dbraw/zinc/25/49/36/600254936.db2.gz	ZXRGFNSCPOSEHU-DEOSSOPVSA-N	-2	1	381.475	2.681	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(N(C)C(=O)[O-])cc2)ccc1F	ZINC000736161392	600255435	/nfs/dbraw/zinc/25/54/35/600255435.db2.gz	OGKSKRMVJQLHEN-UHFFFAOYSA-N	-2	1	381.385	2.699	20	0		GFADML
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)cc1	ZINC000737155869	600299952	/nfs/dbraw/zinc/29/99/52/600299952.db2.gz	YDOFJBFRZYXBMH-UHFFFAOYSA-N	-2	1	392.433	2.774	20	0		GFADML
CC(C)(CCC(=O)[O-])NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000262663567	600384904	/nfs/dbraw/zinc/38/49/04/600384904.db2.gz	UZHRYBDNOPKDTL-UHFFFAOYSA-N	-2	1	390.461	2.861	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cnc3c(cnn3C(C)C)c2)cc1C(=O)[O-]	ZINC000042122926	600541902	/nfs/dbraw/zinc/54/19/02/600541902.db2.gz	XOQHLXVNURNMRF-UHFFFAOYSA-N	-2	1	390.421	2.520	20	0		GFADML
CN(C)c1nc2sc(C(=O)[N-]c3nnc(CCCC(=O)[O-])s3)cc2s1	ZINC000737385619	600554716	/nfs/dbraw/zinc/55/47/16/600554716.db2.gz	GAQCMLAWJVFWDQ-UHFFFAOYSA-N	-2	1	397.507	2.935	20	0		GFADML
CCOC(=O)/C=C/c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000737138175	600626496	/nfs/dbraw/zinc/62/64/96/600626496.db2.gz	ZYZGHZPVYWOJOJ-KPKJPENVSA-N	-2	1	389.429	2.691	20	0		GFADML
O=C([O-])CCCOc1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2F)cc1	ZINC000833227855	600682601	/nfs/dbraw/zinc/68/26/01/600682601.db2.gz	SVMYJNCLPFYNME-UHFFFAOYSA-N	-2	1	397.380	2.568	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)cc1C(=O)[O-]	ZINC000831435365	600689826	/nfs/dbraw/zinc/68/98/26/600689826.db2.gz	VXCZIDOJVPKQJT-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(SC)cc2)cc1C(=O)[O-]	ZINC000831435342	600689951	/nfs/dbraw/zinc/68/99/51/600689951.db2.gz	VHBBVWMARGFGDF-UHFFFAOYSA-N	-2	1	381.431	2.694	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)cc2)c1	ZINC000740074852	600887580	/nfs/dbraw/zinc/88/75/80/600887580.db2.gz	DUHWDBBEVZBBRS-UHFFFAOYSA-N	-2	1	394.836	2.966	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3c(c2)C(=O)OC3)cc1	ZINC000736233346	600899452	/nfs/dbraw/zinc/89/94/52/600899452.db2.gz	YHXASUVWFWHOJV-UHFFFAOYSA-N	-2	1	375.402	2.520	20	0		GFADML
COC(=O)C(C)(C)c1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000737565589	600900201	/nfs/dbraw/zinc/90/02/01/600900201.db2.gz	YCWMEXDJPOCCHB-UHFFFAOYSA-N	-2	1	395.408	2.775	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)[C@@H]1c1ccccc1	ZINC000828394945	600936774	/nfs/dbraw/zinc/93/67/74/600936774.db2.gz	URKPEEDVGAHENC-QKKBWIMNSA-N	-2	1	391.427	2.626	20	0		GFADML
CCOc1ccc(F)c(C(=O)[O-])c1NS(=O)(=O)c1cc(C(=O)[O-])ccc1C	ZINC000462103151	601116508	/nfs/dbraw/zinc/11/65/08/601116508.db2.gz	QFNAVDCTTAXTRH-UHFFFAOYSA-N	-2	1	397.380	2.730	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1	ZINC000484979748	601233708	/nfs/dbraw/zinc/23/37/08/601233708.db2.gz	LFFMUWXWWBDUCG-UHFFFAOYSA-N	-2	1	386.429	2.691	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])c1	ZINC000831705425	601234690	/nfs/dbraw/zinc/23/46/90/601234690.db2.gz	KCRPIFABHLBZGE-UHFFFAOYSA-N	-2	1	383.397	2.740	20	0		GFADML
Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3ccc(/C=C/C(=O)[O-])cc3)cn2)n1	ZINC000832879772	601323283	/nfs/dbraw/zinc/32/32/83/601323283.db2.gz	JYGOAZVATAVQFM-BJMVGYQFSA-N	-2	1	398.444	2.783	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1Cl	ZINC000831015819	601326163	/nfs/dbraw/zinc/32/61/63/601326163.db2.gz	IZTMSPZNFNJVKB-WTKPLQERSA-N	-2	1	394.836	2.598	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])ccc1C	ZINC000831328222	601334307	/nfs/dbraw/zinc/33/43/07/601334307.db2.gz	TWGBIQPDYWOJHG-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1c(F)cccc1N1CCCC1	ZINC000832204230	601361746	/nfs/dbraw/zinc/36/17/46/601361746.db2.gz	PLFSSQWJMDTWPM-UHFFFAOYSA-N	-2	1	394.424	2.934	20	0		GFADML
CC[C@](C)(CC(=O)[O-])NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1	ZINC000767052592	601471581	/nfs/dbraw/zinc/47/15/81/601471581.db2.gz	ZXIMBWSQNJKONT-LJQANCHMSA-N	-2	1	390.461	2.861	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CCC(=O)Nc1ccccc1CC(=O)[O-]	ZINC000370723177	601730067	/nfs/dbraw/zinc/73/00/67/601730067.db2.gz	SMKQBTIMJMPHBB-UHFFFAOYSA-N	-2	1	392.415	2.751	20	0		GFADML
Cn1cnnc1-c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000032596087	601826970	/nfs/dbraw/zinc/82/69/70/601826970.db2.gz	ZHUMVOIUSFHLCC-UHFFFAOYSA-N	-2	1	392.824	2.635	20	0		GFADML
Cc1ccc(C(=O)N(C)C)cc1[N-]S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1	ZINC000832912270	601827795	/nfs/dbraw/zinc/82/77/95/601827795.db2.gz	XBGNEWYIGIIJDJ-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(Cl)nc2C(=O)[O-])cc1Cl	ZINC000833320728	601838272	/nfs/dbraw/zinc/83/82/72/601838272.db2.gz	CHPOHJSXPQSJEO-UHFFFAOYSA-N	-2	1	391.188	2.586	20	0		GFADML
CC(C)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2Br)[nH]n1	ZINC000317514317	601850599	/nfs/dbraw/zinc/85/05/99/601850599.db2.gz	QSEBPUFYNYJKKT-UHFFFAOYSA-N	-2	1	388.243	2.795	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])c2)no1	ZINC000832991828	601860375	/nfs/dbraw/zinc/86/03/75/601860375.db2.gz	RJYDWCYLLRPAKP-UHFFFAOYSA-N	-2	1	377.353	2.683	20	0		GFADML
CCC[C@H](C)c1cc([N-]S(=O)(=O)c2cc(C(=O)OC)ccc2C(=O)[O-])[nH]n1	ZINC000829216033	601861820	/nfs/dbraw/zinc/86/18/20/601861820.db2.gz	IPGSMHZKFXJVDH-JTQLQIEISA-N	-2	1	395.437	2.599	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)Nc2ccccc2NC(=O)[O-])o1	ZINC000738702217	602174467	/nfs/dbraw/zinc/17/44/67/602174467.db2.gz	ASZJRRKJBNKLJV-UHFFFAOYSA-N	-2	1	381.410	2.699	20	0		GFADML
CCOCCOc1ccc(S(=O)(=O)[N-]c2ccccc2NC(=O)[O-])cc1	ZINC000739493899	602652324	/nfs/dbraw/zinc/65/23/24/602652324.db2.gz	RDHPZFGOJRPHTF-UHFFFAOYSA-N	-2	1	380.422	2.993	20	0		GFADML
Cc1ccc(NC(=O)CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])c(Cl)c1	ZINC000740135452	602855150	/nfs/dbraw/zinc/85/51/50/602855150.db2.gz	LBLJTOZXKQONCK-UHFFFAOYSA-N	-2	1	377.784	2.812	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])ccc1C	ZINC000738563487	603192674	/nfs/dbraw/zinc/19/26/74/603192674.db2.gz	XHRAEYFXQQRWGC-UHFFFAOYSA-N	-2	1	389.433	2.795	20	0		GFADML
O=C([O-])N(CC1CC1)C1CCN(Cn2[n-]c(-c3ccccn3)nc2=S)CC1	ZINC000831825826	603495087	/nfs/dbraw/zinc/49/50/87/603495087.db2.gz	FKSHZXDYZBQAIS-UHFFFAOYSA-N	-2	1	388.497	2.815	20	0		GFADML
CCOC(=O)c1sc([C@@H](C)NC(=O)c2ccc(NC(=O)[O-])cc2[O-])nc1C	ZINC000827355340	603805023	/nfs/dbraw/zinc/80/50/23/603805023.db2.gz	HQTBXDUPVAEMCR-SECBINFHSA-N	-2	1	393.421	2.915	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000438791301	604990204	/nfs/dbraw/zinc/99/02/04/604990204.db2.gz	FYZBYOXHMMIEGR-UHFFFAOYSA-N	-2	1	397.840	2.980	20	0		GFADML
O=C(CCC1CCN(C(=O)[O-])CC1)OCc1cc(=O)oc2cc([O-])ccc12	ZINC000833991764	605327045	/nfs/dbraw/zinc/32/70/45/605327045.db2.gz	VCMLOXRFSIPJRR-UHFFFAOYSA-N	-2	1	375.377	2.712	20	0		GFADML
O=C([O-])Nc1cc2c(cc1[N-]S(=O)(=O)c1ccc3c(c1)CCCO3)OCO2	ZINC000834257687	605757060	/nfs/dbraw/zinc/75/70/60/605757060.db2.gz	YRMKUMHYRVHLFT-UHFFFAOYSA-N	-2	1	392.389	2.631	20	0		GFADML
CC(C)Oc1ccc(S(=O)(=O)[N-]c2nc3cccc(C(=O)[O-])c3[nH]2)cc1	ZINC000833506447	605783248	/nfs/dbraw/zinc/78/32/48/605783248.db2.gz	BYJOACBVMSZQCA-UHFFFAOYSA-N	-2	1	375.406	2.849	20	0		GFADML
CC(C)c1ccc(S(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)cc1	ZINC000820192203	606621119	/nfs/dbraw/zinc/62/11/19/606621119.db2.gz	GJYYTTGMRGAWIP-UHFFFAOYSA-N	-2	1	389.485	2.742	20	0		GFADML
CCS(=O)(=O)[N-]c1cc(OC)ccc1S(=O)(=O)[N-]c1ccc(C)cc1	ZINC000270537201	655048070	/nfs/dbraw/zinc/04/80/70/655048070.db2.gz	WRZVSHZLVVYCBF-UHFFFAOYSA-N	-2	1	384.479	2.566	20	0		GFADML
Cc1cc(Br)c(S(=O)(=O)[N-][C@H](CC(F)(F)F)C(=O)[O-])s1	ZINC000275382639	655233102	/nfs/dbraw/zinc/23/31/02/655233102.db2.gz	ZTQZXXHOTNYHSC-ZCFIWIBFSA-N	-2	1	396.206	2.503	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(F)cc2C(=O)[O-])c1Cl	ZINC000753775475	655858312	/nfs/dbraw/zinc/85/83/12/655858312.db2.gz	KEKFNZGKKFGZAN-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(F)c2)c1	ZINC000768503907	656240591	/nfs/dbraw/zinc/24/05/91/656240591.db2.gz	LPZSSXXUPSLHRZ-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])Cc1ccc(CC[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)cc1	ZINC000776549363	656756128	/nfs/dbraw/zinc/75/61/28/656756128.db2.gz	PFBVUBYOOLWOLR-UHFFFAOYSA-N	-2	1	389.260	2.537	20	0		GFADML
O=C([O-])/C=C\C[N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl	ZINC000788449282	657720381	/nfs/dbraw/zinc/72/03/81/657720381.db2.gz	XOMAZQMIYFNZQR-UPHRSURJSA-N	-2	1	389.054	2.675	20	0		GFADML
O=C([O-])[C@H](C[C@@H]1CCCO1)[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000906002481	663907555	/nfs/dbraw/zinc/90/75/55/663907555.db2.gz	YMZWEHWAPBLGEU-ONGXEEELSA-N	-2	1	389.882	2.855	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccccc2[N-]S(C)(=O)=O)sc1Cl	ZINC000190230978	552490774	/nfs/dbraw/zinc/49/07/74/552490774.db2.gz	YMWIBGGSCYLWSS-UHFFFAOYSA-N	-2	1	380.900	2.882	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2c(Cl)cc(Br)cc2Cl)CC1	ZINC000201848535	553052568	/nfs/dbraw/zinc/05/25/68/553052568.db2.gz	MMAFSLNPUPPNRE-UHFFFAOYSA-N	-2	1	389.054	2.651	20	0		GFADML
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccccc1[N-]S(C)(=O)=O	ZINC000243932607	553088740	/nfs/dbraw/zinc/08/87/40/553088740.db2.gz	RUMKXTLYPSCRPV-UHFFFAOYSA-N	-2	1	390.870	2.521	20	0		GFADML
C[C@@H]1C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(Cl)cc3C(=O)[O-])cc21	ZINC000326732300	563455727	/nfs/dbraw/zinc/45/57/27/563455727.db2.gz	HMRAIYVWXLDNKP-QMMMGPOBSA-N	-2	1	380.809	2.895	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc2c(c1)OCCO2	ZINC000327183991	563457039	/nfs/dbraw/zinc/45/70/39/563457039.db2.gz	ZJJXINZRIHOFLX-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
Cc1c[nH]c(NC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])n1	ZINC000436982530	563687612	/nfs/dbraw/zinc/68/76/12/563687612.db2.gz	HKOYDMYATSDSQL-UHFFFAOYSA-N	-2	1	378.435	2.538	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Br)c2)cc1O	ZINC000476420630	564338696	/nfs/dbraw/zinc/33/86/96/564338696.db2.gz	WBEUGQZXTUTGHR-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2cc(F)cc(Cl)c2)cc1F	ZINC000477396589	564375433	/nfs/dbraw/zinc/37/54/33/564375433.db2.gz	AVUVIOREWYGWOF-UHFFFAOYSA-N	-2	1	377.752	2.882	20	0		GFADML
CC[C@@H](CC[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000568726618	564431109	/nfs/dbraw/zinc/43/11/09/564431109.db2.gz	PCIKBYRDOYLSBZ-LURJTMIESA-N	-2	1	390.708	2.943	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2c(C)ccc(Cl)c2C(=O)[O-])c1	ZINC000484802493	564599582	/nfs/dbraw/zinc/59/95/82/564599582.db2.gz	BAIGYHBNCDQPHW-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)Nc1cccc(Cl)c1C(=O)[O-]	ZINC000523125434	564662335	/nfs/dbraw/zinc/66/23/35/564662335.db2.gz	XKXVWHZYPIURAA-UHFFFAOYSA-N	-2	1	375.811	2.907	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)c1	ZINC000462097805	564818645	/nfs/dbraw/zinc/81/86/45/564818645.db2.gz	ATBBOECPGJEZDV-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)[C@H](C)C(=O)[O-]	ZINC000556702379	564836687	/nfs/dbraw/zinc/83/66/87/564836687.db2.gz	CLHSMPQZPDVVMY-CRCLSJGQSA-N	-2	1	376.681	2.552	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1Cl)C(F)(F)F	ZINC000556774188	564839295	/nfs/dbraw/zinc/83/92/95/564839295.db2.gz	UBIREIJGSZPNQP-ZCFIWIBFSA-N	-2	1	380.171	2.925	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2cccc(O)c2F)c(Cl)cc1C(=O)[O-]	ZINC000536611616	565042565	/nfs/dbraw/zinc/04/25/65/565042565.db2.gz	SQDZBEXCBBPNAE-UHFFFAOYSA-N	-2	1	375.761	2.692	20	0		GFADML
Cc1c(Cl)ccc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000618761893	565314313	/nfs/dbraw/zinc/31/43/13/565314313.db2.gz	SUIPRDYKTLNWJW-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
O=C([O-])CC[C@@H](C[N-]S(=O)(=O)c1cccc(Cl)c1F)C(F)(F)F	ZINC000663294414	565408404	/nfs/dbraw/zinc/40/84/04/565408404.db2.gz	QLKWUPBKCLAHAL-ZETCQYMHSA-N	-2	1	377.743	2.801	20	0		GFADML
COc1nc2ccc([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)cc2s1	ZINC000671166947	565754307	/nfs/dbraw/zinc/75/43/07/565754307.db2.gz	GKALMHTUWBWTNO-UHFFFAOYSA-N	-2	1	378.431	2.733	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)CC1CC1	ZINC000650432429	565821017	/nfs/dbraw/zinc/82/10/17/565821017.db2.gz	ZCLMIBWIRRYSDK-QMMMGPOBSA-N	-2	1	398.225	2.507	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C[S@](C)=O)c1C	ZINC000609730599	566050986	/nfs/dbraw/zinc/05/09/86/566050986.db2.gz	XKDUXRSQVTXYCM-DEOSSOPVSA-N	-2	1	381.475	2.681	20	0		GFADML
Cc1c(Cl)ccc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2[nH]c(=O)oc2c1	ZINC000681562631	566111899	/nfs/dbraw/zinc/11/18/99/566111899.db2.gz	ZMAHYNMZKQDLPE-UHFFFAOYSA-N	-2	1	382.781	2.994	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)NCCCC(=O)[O-])cc2)c1C	ZINC000262673404	597275445	/nfs/dbraw/zinc/27/54/45/597275445.db2.gz	XUSPHNMNHBVTLO-UHFFFAOYSA-N	-2	1	390.461	2.699	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl)C(=O)[O-]	ZINC000034936961	601132481	/nfs/dbraw/zinc/13/24/81/601132481.db2.gz	OKYDYHDQATUGRO-BYPYZUCNSA-N	-2	1	377.043	2.507	20	0		GFADML
CC[C@@H](NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CCCCC1	ZINC000736916469	599703482	/nfs/dbraw/zinc/70/34/82/599703482.db2.gz	HOFXJFKNUNLQIF-GOSISDBHSA-N	-2	1	385.464	2.881	20	0		GFADML
CSc1ccc([C@@H](CC(=O)[O-])NC(=O)c2nc3ccccc3c(=O)[n-]2)cc1	ZINC000738203418	599881220	/nfs/dbraw/zinc/88/12/20/599881220.db2.gz	XWDZGISVTIHFQS-OAHLLOKOSA-N	-2	1	383.429	2.591	20	0		GFADML
COC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1	ZINC000737632056	599907530	/nfs/dbraw/zinc/90/75/30/599907530.db2.gz	DNPYJSBYWGIJMA-UHFFFAOYSA-N	-2	1	378.406	2.697	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)Nc3cccc4[nH]ccc43)cc2)[n-]1	ZINC000739878132	599988022	/nfs/dbraw/zinc/98/80/22/599988022.db2.gz	YLBUTXLPVSURIM-UHFFFAOYSA-N	-2	1	376.372	2.526	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1Cc1nc(-c2ccc(C(=O)[O-])cc2)no1	ZINC000738838052	600113889	/nfs/dbraw/zinc/11/38/89/600113889.db2.gz	NDVNHINALVDBPD-UHFFFAOYSA-N	-2	1	389.371	2.892	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@@H](C(=O)[O-])c1ccc(F)cc1	ZINC000737039052	600451826	/nfs/dbraw/zinc/45/18/26/600451826.db2.gz	NQFXCAFBGGJNCA-MRXNPFEDSA-N	-2	1	395.408	2.960	20	0		GFADML
Cc1ccnc(-c2ccc([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)cc2)n1	ZINC000481944175	600612007	/nfs/dbraw/zinc/61/20/07/600612007.db2.gz	HESZBTVJFQWTNN-UHFFFAOYSA-N	-2	1	383.429	2.880	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)ccc1C(=O)NC(C)C	ZINC000267160907	600628689	/nfs/dbraw/zinc/62/86/89/600628689.db2.gz	JMUFRHWSMXJITR-UHFFFAOYSA-N	-2	1	390.461	2.561	20	0		GFADML
CC(=O)N(Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1)C1CC1	ZINC000265422398	600636115	/nfs/dbraw/zinc/63/61/15/600636115.db2.gz	AUMLPUTYJJSZRV-UHFFFAOYSA-N	-2	1	388.445	2.697	20	0		GFADML
CCc1ccc([C@@H](COC)[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)o1	ZINC000761309616	600763073	/nfs/dbraw/zinc/76/30/73/600763073.db2.gz	MERQCDDRQBHFNM-CYBMUJFWSA-N	-2	1	387.841	2.860	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cs1)c1nc(-c2cccc(F)c2)no1	ZINC000827746822	600800664	/nfs/dbraw/zinc/80/06/64/600800664.db2.gz	GWSUOBWJENJVFY-QMMMGPOBSA-N	-2	1	397.409	2.675	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])n(C)c2)cc1OC1CCCC1	ZINC000832419688	600810991	/nfs/dbraw/zinc/81/09/91/600810991.db2.gz	YSFUITXCOMUNPP-UHFFFAOYSA-N	-2	1	394.449	2.854	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000042796171	600811430	/nfs/dbraw/zinc/81/14/30/600811430.db2.gz	KCIQUMVMKPKSSU-UHFFFAOYSA-N	-2	1	376.434	2.552	20	0		GFADML
C[C@@H](NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)[C@@H](C)c1ccccc1	ZINC000827695265	601184673	/nfs/dbraw/zinc/18/46/73/601184673.db2.gz	PYRHDSIIRKAQIB-HUUCEWRRSA-N	-2	1	393.443	2.715	20	0		GFADML
COC[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])c(Cl)cc1Cl)c1ccco1	ZINC000831654441	601262910	/nfs/dbraw/zinc/26/29/10/601262910.db2.gz	AHZYNZWKHYZFQQ-NSHDSACASA-N	-2	1	394.232	2.951	20	0		GFADML
Cn1cc(NC(=O)c2ccc([N-]S(=O)(=O)c3ccccc3)cc2)cc1C(=O)[O-]	ZINC000833052382	601323462	/nfs/dbraw/zinc/32/34/62/601323462.db2.gz	VKAROIOGVMSPBU-UHFFFAOYSA-N	-2	1	399.428	2.776	20	0		GFADML
CCCNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000829519670	601323553	/nfs/dbraw/zinc/32/35/53/601323553.db2.gz	OCVQPQVHGSYNKW-DHZHZOJOSA-N	-2	1	388.445	2.725	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccc(C=CC(=O)[O-])cc3)c2)n[nH]1	ZINC000832992011	601326429	/nfs/dbraw/zinc/32/64/29/601326429.db2.gz	ZEOPGYLUCJVOMB-JXMROGBWSA-N	-2	1	384.417	2.679	20	0		GFADML
Cc1sc(C(=O)[O-])cc1COC(=O)CCc1c(C)nc2cc(=O)[n-]n2c1C	ZINC000833004733	601726181	/nfs/dbraw/zinc/72/61/81/601726181.db2.gz	XPSLDLYXAHGFPA-UHFFFAOYSA-N	-2	1	389.433	2.796	20	0		GFADML
CC[C@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C)c(F)c2)c1)C(=O)[O-]	ZINC000485874515	601750916	/nfs/dbraw/zinc/75/09/16/601750916.db2.gz	JALKTOZLCVKZMX-INIZCTEOSA-N	-2	1	394.424	2.528	20	0		GFADML
CC[C@H](NC(=O)c1cccc([N-]S(=O)(=O)c2cc(C)ccc2C)c1)C(=O)[O-]	ZINC000263030334	601753795	/nfs/dbraw/zinc/75/37/95/601753795.db2.gz	ULJYRSXWFFULFU-INIZCTEOSA-N	-2	1	390.461	2.697	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3ccc(C(=O)[O-])c(C)c3)ccc2o1	ZINC000831795813	601795117	/nfs/dbraw/zinc/79/51/17/601795117.db2.gz	MRUOWMJGBOKCPB-UHFFFAOYSA-N	-2	1	390.417	2.824	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000729666881	601828481	/nfs/dbraw/zinc/82/84/81/601828481.db2.gz	GCNKKQLDTMHUBU-UHFFFAOYSA-N	-2	1	397.836	2.945	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-n3cccn3)c(F)c2)cc(F)c1F	ZINC000175964290	601836352	/nfs/dbraw/zinc/83/63/52/601836352.db2.gz	JYSHRIQPHDZNBN-UHFFFAOYSA-N	-2	1	397.334	2.789	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1cccc(Oc2cnccn2)c1	ZINC000833295243	601858464	/nfs/dbraw/zinc/85/84/64/601858464.db2.gz	SVMPYLKWTRUDET-UHFFFAOYSA-N	-2	1	389.364	2.907	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(Cn2cccn2)cc1	ZINC000833295303	601858838	/nfs/dbraw/zinc/85/88/38/601858838.db2.gz	VEFMMKOCSXOQLH-UHFFFAOYSA-N	-2	1	375.381	2.570	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1cccc(CC(=O)[O-])c1	ZINC000428098274	602077397	/nfs/dbraw/zinc/07/73/97/602077397.db2.gz	UXWWHNPTKPIHOO-UHFFFAOYSA-N	-2	1	376.434	2.718	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)OCCCNC(=O)[O-])cc1	ZINC000740192632	602228728	/nfs/dbraw/zinc/22/87/28/602228728.db2.gz	AWKYOTWKDHNWRI-UHFFFAOYSA-N	-2	1	392.433	2.610	20	0		GFADML
CN(Cc1ccc(C(=O)NC2CC2)cc1)C(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000739705495	602847360	/nfs/dbraw/zinc/84/73/60/602847360.db2.gz	QGEZSDYVFRNJBI-UHFFFAOYSA-N	-2	1	383.404	2.647	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c([O-])c1	ZINC000740700425	602848095	/nfs/dbraw/zinc/84/80/95/602848095.db2.gz	MRLDJEDPWYKDLS-MRXNPFEDSA-N	-2	1	385.376	2.852	20	0		GFADML
C[C@@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1cccc(N2CCOC2=O)c1	ZINC000739021624	602854379	/nfs/dbraw/zinc/85/43/79/602854379.db2.gz	FPORBNHSOMWCHT-LLVKDONJSA-N	-2	1	385.376	2.930	20	0		GFADML
CCOc1c(OC)cc(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])cc1OC	ZINC000739488040	602856967	/nfs/dbraw/zinc/85/69/67/602856967.db2.gz	RHQVLEYZNLXMCH-UHFFFAOYSA-N	-2	1	390.392	2.828	20	0		GFADML
CN(C(=O)[O-])[C@H]1CCCN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1	ZINC000739583107	602858785	/nfs/dbraw/zinc/85/87/85/602858785.db2.gz	DNNVWXCLQRDAFH-ZDUSSCGKSA-N	-2	1	393.440	2.954	20	0		GFADML
CN(C(=O)[O-])C1CCN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])CC1	ZINC000737934639	602862569	/nfs/dbraw/zinc/86/25/69/602862569.db2.gz	XGHWJRPUFUMUPR-UHFFFAOYSA-N	-2	1	393.440	2.954	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC([C@H]2CCCN2C(=O)[O-])CC1	ZINC000830708497	603481131	/nfs/dbraw/zinc/48/11/31/603481131.db2.gz	BMLUIXFDTSVEOD-CQSZACIVSA-N	-2	1	376.457	2.609	20	0		GFADML
CCN(C[C@H]1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1)CC(F)(F)F	ZINC000827084120	603702876	/nfs/dbraw/zinc/70/28/76/603702876.db2.gz	QWCFHDMWRITDTO-LLVKDONJSA-N	-2	1	389.374	2.828	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CCC(=O)Nc1cc(C(=O)[O-])cs1	ZINC000832993317	604316524	/nfs/dbraw/zinc/31/65/24/604316524.db2.gz	RVTUXXSXGSLFIG-UHFFFAOYSA-N	-2	1	384.417	2.884	20	0		GFADML
CCCCC[C@H]1CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829348514	604343049	/nfs/dbraw/zinc/34/30/49/604343049.db2.gz	SAZRMQOAKYPYQL-KRWDZBQOSA-N	-2	1	385.464	2.978	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)[O-]	ZINC000833004333	604375742	/nfs/dbraw/zinc/37/57/42/604375742.db2.gz	NGPXIPLNFWLAQZ-LJQANCHMSA-N	-2	1	396.447	2.563	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ncc(Br)cc2F)cc1C(=O)[O-]	ZINC000833750875	604702965	/nfs/dbraw/zinc/70/29/65/604702965.db2.gz	FKORFLBDVSCOSJ-UHFFFAOYSA-N	-2	1	389.202	2.791	20	0		GFADML
CC(C)COC[C@H]([N-]S(=O)(=O)c1cc(F)ccc1C(=O)[O-])c1ccco1	ZINC000833487780	605023649	/nfs/dbraw/zinc/02/36/49/605023649.db2.gz	HNNMOGNAUJVAAM-AWEZNQCLSA-N	-2	1	385.413	2.809	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)c1	ZINC000829217270	605237712	/nfs/dbraw/zinc/23/77/12/605237712.db2.gz	MOTYWSLDFTVOLW-NSHDSACASA-N	-2	1	380.422	2.833	20	0		GFADML
O=S(=O)([N-]c1cncc2ccccc21)c1cccc(Cl)c1-c1nn[n-]n1	ZINC000826493068	607983133	/nfs/dbraw/zinc/98/31/33/607983133.db2.gz	RGQTWUXQUUAPMP-UHFFFAOYSA-N	-2	1	386.824	2.869	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1C	ZINC000013278967	654504012	/nfs/dbraw/zinc/50/40/12/654504012.db2.gz	NUHWIMQGENSQPF-UHFFFAOYSA-N	-3	1	381.431	2.914	20	0		GFADML
O=C(N[N-]S(=O)(=O)c1ccc2c(c1)CCCC2)c1ccc(Cl)cc1[O-]	ZINC000055664944	654780085	/nfs/dbraw/zinc/78/00/85/654780085.db2.gz	WKNCRUZRBSGIKW-UHFFFAOYSA-N	-2	1	380.853	2.548	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C[C@H]1C	ZINC000268199259	654963003	/nfs/dbraw/zinc/96/30/03/654963003.db2.gz	OIBQQNBUBUVLRN-TXEJJXNPSA-N	-2	1	380.491	2.983	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]CCc2ccc(Cl)cc2)c1	ZINC000325855899	655384690	/nfs/dbraw/zinc/38/46/90/655384690.db2.gz	VBRCGUJTUZOOMB-UHFFFAOYSA-N	-2	1	375.780	2.837	20	0		GFADML
COc1cc(Cl)c(S(=O)(=O)[N-]c2c(O)cccc2F)cc1C(=O)[O-]	ZINC000790391781	657967135	/nfs/dbraw/zinc/96/71/35/657967135.db2.gz	XKZSIVWRHWVNDZ-UHFFFAOYSA-N	-2	1	375.761	2.692	20	0		GFADML
Cc1cnc(SCC(=O)C2([N-]C(=O)C(F)(F)F)CCCCC2)[n-]c1=O	ZINC000849902923	661751469	/nfs/dbraw/zinc/75/14/69/661751469.db2.gz	GNEXKUHHZKTQDC-UHFFFAOYSA-N	-2	1	377.388	2.533	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]CCc2cccc(Cl)c2)c1	ZINC000392435440	677409835	/nfs/dbraw/zinc/40/98/35/677409835.db2.gz	KTLPRUAUXGPCRY-UHFFFAOYSA-N	-2	1	375.780	2.837	20	0		GFADML
COc1cc(Br)cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)c1	ZINC000317033822	563442319	/nfs/dbraw/zinc/44/23/19/563442319.db2.gz	ZFNXSGYRLPAYOY-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
CNC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2C)c1	ZINC000327055449	563456701	/nfs/dbraw/zinc/45/67/01/563456701.db2.gz	VIAZIQNTOSSOOT-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
CC(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2[O-])cc1Cl	ZINC000433803743	563619957	/nfs/dbraw/zinc/61/99/57/563619957.db2.gz	NPFAVRNGPUKOJT-UHFFFAOYSA-N	-2	1	384.797	2.503	20	0		GFADML
COc1cc(Br)cc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2)c1	ZINC000544817476	564400492	/nfs/dbraw/zinc/40/04/92/564400492.db2.gz	UYTNQGNXHXMDQB-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccccc2C[S@@](C)=O)cc(C(=O)[O-])c1C	ZINC000545120603	564409104	/nfs/dbraw/zinc/40/91/04/564409104.db2.gz	PMMNQRUKDBJIPZ-XMMPIXPASA-N	-2	1	381.475	2.681	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccccc2CSC)cc1CC(=O)[O-]	ZINC000546071768	564443127	/nfs/dbraw/zinc/44/31/27/564443127.db2.gz	BWMNHYPLFKBPGA-UHFFFAOYSA-N	-2	1	381.475	2.986	20	0		GFADML
COc1nc2ccc([N-]S(=O)(=O)c3ccc(C(=O)[O-])c(F)c3)cc2s1	ZINC000514804401	564458370	/nfs/dbraw/zinc/45/83/70/564458370.db2.gz	SRTLRXJMZCKSAU-UHFFFAOYSA-N	-2	1	382.394	2.943	20	0		GFADML
COC(=O)c1ccc(F)cc1S(=O)(=O)[N-]c1c(Cl)cccc1C(=O)[O-]	ZINC000547547267	564493681	/nfs/dbraw/zinc/49/36/81/564493681.db2.gz	QOFLLZULABCKFB-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CC(C)[C@H](C[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000547931818	564521972	/nfs/dbraw/zinc/52/19/72/564521972.db2.gz	JUDSHBUXYPIQIO-LURJTMIESA-N	-2	1	390.708	2.799	20	0		GFADML
C[C@@H](CCC(=O)[O-])C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000548219949	564538503	/nfs/dbraw/zinc/53/85/03/564538503.db2.gz	VJTDBUCEXPWCCO-ZETCQYMHSA-N	-2	1	386.214	2.507	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000525531341	564702572	/nfs/dbraw/zinc/70/25/72/564702572.db2.gz	TWWWWYSAEARLGT-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COCc1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(OC)c2)c1	ZINC000580984799	564782511	/nfs/dbraw/zinc/78/25/11/564782511.db2.gz	XNCSVSUTKJZSNA-UHFFFAOYSA-N	-2	1	385.825	2.994	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(F)c1	ZINC000532844597	564947553	/nfs/dbraw/zinc/94/75/53/564947553.db2.gz	JODAQSWARUPGFM-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])CC[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1F)C(F)(F)F	ZINC000663293411	565407805	/nfs/dbraw/zinc/40/78/05/565407805.db2.gz	GLTLTVHGCCDENX-SSDOTTSWSA-N	-2	1	377.743	2.801	20	0		GFADML
CCC[C@H](CCCC[N-]S(=O)(=O)c1c(F)cc(OC)cc1F)C(=O)[O-]	ZINC000669623297	565696173	/nfs/dbraw/zinc/69/61/73/565696173.db2.gz	HCGPIBKGHVSYTG-LLVKDONJSA-N	-2	1	379.425	2.923	20	0		GFADML
CCC(C)(C)CS(=O)(=O)[N-]c1c(C(=O)[O-])cc(OC)c(OC)c1OC	ZINC000629292210	565835886	/nfs/dbraw/zinc/83/58/86/565835886.db2.gz	DGHLWPKHGJGGNU-UHFFFAOYSA-N	-2	1	375.443	2.589	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)Nc3cccc(C(F)F)c3)cc2)[n-]1	ZINC000739877174	599704805	/nfs/dbraw/zinc/70/48/05/599704805.db2.gz	MZKYRKWYIIVZCE-UHFFFAOYSA-N	-2	1	387.342	2.983	20	0		GFADML
CC(C)[C@@H]1CCC[C@H](NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736394125	600078142	/nfs/dbraw/zinc/07/81/42/600078142.db2.gz	GMBXZSDSGBLBTL-CVEARBPZSA-N	-2	1	385.464	2.737	20	0		GFADML
CC(C)[C@@H]1CCC[C@@H](NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736394127	600078215	/nfs/dbraw/zinc/07/82/15/600078215.db2.gz	GMBXZSDSGBLBTL-HZPDHXFCSA-N	-2	1	385.464	2.737	20	0		GFADML
CC(=O)N1CCc2cc(S(=O)(=O)[N-]c3ccc(F)c(NC(=O)[O-])c3)ccc21	ZINC000736138902	600100362	/nfs/dbraw/zinc/10/03/62/600100362.db2.gz	NIGSRAREQJPFGV-UHFFFAOYSA-N	-2	1	393.396	2.625	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2N2CCCC2)cc1F	ZINC000738063748	600105707	/nfs/dbraw/zinc/10/57/07/600105707.db2.gz	JNWANPYQPQMTKG-UHFFFAOYSA-N	-2	1	394.424	2.934	20	0		GFADML
C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736764866	600184401	/nfs/dbraw/zinc/18/44/01/600184401.db2.gz	XFNBZBOBYCLTDU-SIIHOXLZSA-N	-2	1	383.448	2.586	20	0		GFADML
CC(=O)N(Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1)C(C)C	ZINC000523959227	600253482	/nfs/dbraw/zinc/25/34/82/600253482.db2.gz	VIGRFBIPNZQNEN-UHFFFAOYSA-N	-2	1	390.461	2.943	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)O[C@@H](C(=O)[O-])c1cccc(Cl)c1	ZINC000738873601	600329968	/nfs/dbraw/zinc/32/99/68/600329968.db2.gz	XTOJSECDDIIEKH-QGZVFWFLSA-N	-2	1	389.795	2.617	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2cccc(-c3cn4cccnc4n3)c2)c1	ZINC000605498369	600423405	/nfs/dbraw/zinc/42/34/05/600423405.db2.gz	RSLHQBHQMJHYFC-UHFFFAOYSA-N	-2	1	394.412	2.895	20	0		GFADML
O=C([O-])CCCc1nnc([N-]C(=O)c2cnc(-c3ccccn3)s2)s1	ZINC000739710141	600536476	/nfs/dbraw/zinc/53/64/76/600536476.db2.gz	AIEJJTLROPLSQT-UHFFFAOYSA-N	-2	1	375.435	2.716	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)c1	ZINC000737654846	600636690	/nfs/dbraw/zinc/63/66/90/600636690.db2.gz	YCGYLFHNLPSFMS-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COc1ccc(Cl)c(C(=O)[O-])c1NS(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000506672738	600891987	/nfs/dbraw/zinc/89/19/87/600891987.db2.gz	CPHREABTCXHORL-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)c1	ZINC000737654167	600894246	/nfs/dbraw/zinc/89/42/46/600894246.db2.gz	OIQOURAZSLSOCS-UHFFFAOYSA-N	-2	1	398.824	2.695	20	0		GFADML
CCC(=O)Nc1ccc(C)c([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000042792381	601322931	/nfs/dbraw/zinc/32/29/31/601322931.db2.gz	BXTMFQPJQMEUMA-UHFFFAOYSA-N	-2	1	380.397	2.982	20	0		GFADML
CC(C)n1ncc2cc([N-]S(=O)(=O)c3ccc(/C=C\C(=O)[O-])cc3)cnc21	ZINC000827201564	601323205	/nfs/dbraw/zinc/32/32/05/601323205.db2.gz	WLGUUNFTHDGZRD-YVMONPNESA-N	-2	1	386.433	2.911	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2C)c1	ZINC000832182529	601331809	/nfs/dbraw/zinc/33/18/09/601331809.db2.gz	KYZJFFRKJAYXSA-UHFFFAOYSA-N	-3	1	399.808	2.854	20	0		GFADML
Cc1nnc(-c2ccc([N-]S(=O)(=O)c3ccc(/C=C\C(=O)[O-])cc3)cc2)o1	ZINC000833017640	601333196	/nfs/dbraw/zinc/33/31/96/601333196.db2.gz	QZTBWKHHQBSOKK-WCIBSUBMSA-N	-2	1	385.401	2.944	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)Nc2ccc(F)cc2C(=O)[O-])c(Cl)cc1F	ZINC000063877577	601834096	/nfs/dbraw/zinc/83/40/96/601834096.db2.gz	CGOHGTLIBUAMNH-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1)c1nc(C2CC2)no1	ZINC000826717804	601838183	/nfs/dbraw/zinc/83/81/83/601838183.db2.gz	WANFBXUDTBBMST-CYBMUJFWSA-N	-2	1	399.856	2.974	20	0		GFADML
CC(=O)Nc1c(C)ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])c1C	ZINC000825879104	601847873	/nfs/dbraw/zinc/84/78/73/601847873.db2.gz	JFSINBALLLPCOU-UHFFFAOYSA-N	-2	1	380.397	2.900	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc2c(c1)CCCC(=O)N2	ZINC000833357659	601862268	/nfs/dbraw/zinc/86/22/68/601862268.db2.gz	ZSEAEXKLOLQGEZ-UHFFFAOYSA-N	-2	1	378.381	2.600	20	0		GFADML
COC(=O)C(C)(C)c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000831053074	601862907	/nfs/dbraw/zinc/86/29/07/601862907.db2.gz	JZKYPMXMWXPRKL-UHFFFAOYSA-N	-2	1	395.408	2.775	20	0		GFADML
O=C([O-])c1nscc1NS(=O)(=O)c1cc(C(=O)[O-])cc(Cl)c1Cl	ZINC000833298357	602202032	/nfs/dbraw/zinc/20/20/32/602202032.db2.gz	YKVXFLXEOAQCDY-UHFFFAOYSA-N	-2	1	397.217	2.647	20	0		GFADML
CS(=O)(=O)c1cc(NC(=O)c2cc3ccccc3cc2[O-])cc(C(=O)[O-])c1	ZINC000832713753	602300424	/nfs/dbraw/zinc/30/04/24/602300424.db2.gz	MSFGLMCLSCNYKY-UHFFFAOYSA-N	-2	1	385.397	2.899	20	0		GFADML
CCN1C[C@@H](CN(C)C(=O)c2ccc(NC(=O)[O-])cc2[O-])Oc2ccccc21	ZINC000739452283	602842822	/nfs/dbraw/zinc/84/28/22/602842822.db2.gz	RMAGMYGXOCIPPS-CQSZACIVSA-N	-2	1	385.420	2.842	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NC[C@@H]2CCCN(C(=O)[O-])C2)c([O-])c1	ZINC000738722258	602856157	/nfs/dbraw/zinc/85/61/57/602856157.db2.gz	CLDMVKRSFHROKR-LBPRGKRZSA-N	-2	1	393.440	2.859	20	0		GFADML
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000738702719	602862620	/nfs/dbraw/zinc/86/26/20/602862620.db2.gz	KIGICJQCFLKZQQ-LBPRGKRZSA-N	-2	1	379.413	2.611	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C[C@@H](C)N1C(=O)[O-]	ZINC000739172737	602864431	/nfs/dbraw/zinc/86/44/31/602864431.db2.gz	XGRGHNFKEARFNQ-VXGBXAGGSA-N	-2	1	393.440	2.952	20	0		GFADML
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738710030	602864754	/nfs/dbraw/zinc/86/47/54/602864754.db2.gz	RWBBVXCXWMFODC-GFCCVEGCSA-N	-2	1	379.413	2.611	20	0		GFADML
CC(C)(CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1)NC(=O)[O-]	ZINC000738734506	603111787	/nfs/dbraw/zinc/11/17/87/603111787.db2.gz	JIBHNKMKRQUXDK-UHFFFAOYSA-N	-2	1	391.449	2.862	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN(C(=O)[O-])C3)cc1C(=O)[O-]	ZINC000740151017	603182946	/nfs/dbraw/zinc/18/29/46/603182946.db2.gz	RWAUMNJIIJVOCX-UHFFFAOYSA-N	-3	1	390.417	2.530	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)cc1	ZINC000828789198	603400265	/nfs/dbraw/zinc/40/02/65/603400265.db2.gz	RDUPTWCFWWADGI-NSHDSACASA-N	-2	1	378.406	2.603	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])CCN1C(=O)[O-]	ZINC000826035174	603875941	/nfs/dbraw/zinc/87/59/41/603875941.db2.gz	QHSCXXIMKVTPCY-LLVKDONJSA-N	-2	1	379.413	2.564	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])cc1	ZINC000823537525	604013214	/nfs/dbraw/zinc/01/32/14/604013214.db2.gz	HWGVDOBSJBCSRP-UHFFFAOYSA-N	-2	1	389.433	2.511	20	0		GFADML
CCOc1cc(-c2noc(C3(NC(=O)[O-])CC3)n2)cc(Br)c1[O-]	ZINC000827409505	604424016	/nfs/dbraw/zinc/42/40/16/604424016.db2.gz	OUPPFSUHKCWVBR-UHFFFAOYSA-N	-2	1	384.186	2.860	20	0		GFADML
CC(C)c1cccnc1[N-]S(=O)(=O)c1cccc(Cl)c1-c1nn[n-]n1	ZINC000824352576	607694366	/nfs/dbraw/zinc/69/43/66/607694366.db2.gz	JFQDOTWCZAABAR-UHFFFAOYSA-N	-2	1	378.845	2.839	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)c1cc(Cl)c(F)c(C(=O)[O-])c1	ZINC000832918960	604633759	/nfs/dbraw/zinc/63/37/59/604633759.db2.gz	QZCATSUJOMKOQX-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
C[C@H]1CCCN(c2nc([O-])c(CC(=O)Nc3ccsc3C(=O)[O-])s2)C1	ZINC000833615058	604999949	/nfs/dbraw/zinc/99/99/49/604999949.db2.gz	ZSMUAFQCGWAEDH-ONGXEEELSA-N	-2	1	381.479	2.505	20	0		GFADML
CC(C)COC[C@@H]([N-]S(=O)(=O)c1cccc(F)c1C(=O)[O-])c1ccco1	ZINC000833489701	605022823	/nfs/dbraw/zinc/02/28/23/605022823.db2.gz	YXGLBPUQASSLOD-CYBMUJFWSA-N	-2	1	385.413	2.809	20	0		GFADML
C[C@@H](OC(=O)c1cc(F)cc(Cl)c1[O-])C(=O)NCc1ccc(C(=O)[O-])cc1	ZINC000833531663	605056607	/nfs/dbraw/zinc/05/66/07/605056607.db2.gz	LGHLXBCRDABAEO-SECBINFHSA-N	-2	1	395.770	2.745	20	0		GFADML
Cc1cc(F)cc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(C2(C(=O)[O-])CC2)cc1	ZINC000833744508	605125581	/nfs/dbraw/zinc/12/55/81/605125581.db2.gz	DKJZUAYFRYNHLC-UHFFFAOYSA-N	-3	1	393.392	2.749	20	0		GFADML
CCS[C@@H](C)c1noc(CN(C)C(=O)c2ccc(NC(=O)[O-])cc2[O-])n1	ZINC000827494839	605414419	/nfs/dbraw/zinc/41/44/19/605414419.db2.gz	DLWKTHHPGCRKDI-VIFPVBQESA-N	-2	1	380.426	2.951	20	0		GFADML
O=S(=O)([N-]c1ncc(C2CCCCC2)s1)c1ccc(-c2nnn[n-]2)nc1	ZINC000826493307	609460713	/nfs/dbraw/zinc/46/07/13/609460713.db2.gz	FBJMLONJPGEUQF-UHFFFAOYSA-N	-2	1	391.482	2.567	20	0		GFADML
O=S(=O)([N-]c1ncc(C2CCCCC2)s1)c1ccc(-c2nn[n-]n2)nc1	ZINC000826493307	609460714	/nfs/dbraw/zinc/46/07/14/609460714.db2.gz	FBJMLONJPGEUQF-UHFFFAOYSA-N	-2	1	391.482	2.567	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(N=S(C)(C)=O)cc1	ZINC000821106111	660315787	/nfs/dbraw/zinc/31/57/87/660315787.db2.gz	CXNCDCQXUBAZDE-UHFFFAOYSA-N	-2	1	382.463	2.853	20	0		GFADML
CN(C)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])c(Cl)cc2Cl)ccn1	ZINC000830631314	660667785	/nfs/dbraw/zinc/66/77/85/660667785.db2.gz	BIPOKQMKJQCBJY-UHFFFAOYSA-N	-2	1	390.248	2.953	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(N2CCOC2=O)cc1	ZINC000729665650	655566489	/nfs/dbraw/zinc/56/64/89/655566489.db2.gz	IQCOHYOBACNAND-UHFFFAOYSA-N	-2	1	382.419	2.512	20	0		GFADML
COC[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cc(C)c1Cl)c1ccc(C)o1	ZINC000761308987	656009989	/nfs/dbraw/zinc/00/99/89/656009989.db2.gz	KWFZACLOFOYCHC-LBPRGKRZSA-N	-2	1	387.841	2.914	20	0		GFADML
COC[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])c(F)cc1Cl)c1ccc(C)o1	ZINC000761309806	656010184	/nfs/dbraw/zinc/01/01/84/656010184.db2.gz	QOQSPYCNPFPSMZ-LBPRGKRZSA-N	-2	1	391.804	2.745	20	0		GFADML
CC(C)(C)[C@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000776571411	656760199	/nfs/dbraw/zinc/76/01/99/656760199.db2.gz	OXZOUVFVRRQJEF-VIFPVBQESA-N	-2	1	399.694	2.665	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccccc1	ZINC000776571652	656760713	/nfs/dbraw/zinc/76/07/13/656760713.db2.gz	TVQOMMYXDSBMCK-LLVKDONJSA-N	-2	1	389.260	2.925	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]Cc2ccc(Cl)cc2F)c1	ZINC000777949651	656845444	/nfs/dbraw/zinc/84/54/44/656845444.db2.gz	LPELIAOKDBMWOE-UHFFFAOYSA-N	-2	1	379.743	2.934	20	0		GFADML
O=C([N-]c1nnc(C(F)(F)F)s1)c1ccc(C[N-]C(=O)C(F)(F)F)o1	ZINC000858694245	662119710	/nfs/dbraw/zinc/11/97/10/662119710.db2.gz	JPTZLEUTYSMERU-UHFFFAOYSA-N	-2	1	388.249	2.581	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(O)c2)ccc1Br	ZINC000013464513	551109039	/nfs/dbraw/zinc/10/90/39/551109039.db2.gz	RLRBSXCXUWXUAU-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
COc1cc(Br)cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)c1	ZINC000317461829	563442304	/nfs/dbraw/zinc/44/23/04/563442304.db2.gz	YAHRNRYEYPALDX-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
O=C([O-])C[C@H](CC[N-]S(=O)(=O)c1cnc(Cl)c(Cl)c1)C(F)(F)F	ZINC000285033115	563499431	/nfs/dbraw/zinc/49/94/31/563499431.db2.gz	IPINGDOOKDBDPD-LURJTMIESA-N	-2	1	395.186	2.710	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])c1	ZINC000393116318	563528378	/nfs/dbraw/zinc/52/83/78/563528378.db2.gz	BQITXXIHGILHMJ-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc(-c2nc(-c3cc(Br)c([O-])c(OC)c3)no2)[nH]1	ZINC000436786750	563679375	/nfs/dbraw/zinc/67/93/75/563679375.db2.gz	YZNFHUGQYRZVDR-UHFFFAOYSA-N	-2	1	394.181	2.995	20	0		GFADML
O=S(=O)([N-]c1ccn(CC(F)(F)F)n1)c1cc(C(F)(F)F)ccc1[O-]	ZINC000451022397	564264285	/nfs/dbraw/zinc/26/42/85/564264285.db2.gz	HNPUQRHYLUIBPC-UHFFFAOYSA-N	-2	1	389.277	2.971	20	0		GFADML
Cn1ncc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2[O-])c1C(F)(F)F	ZINC000451041914	564266697	/nfs/dbraw/zinc/26/66/97/564266697.db2.gz	OWHUFAVUAFEANZ-UHFFFAOYSA-N	-2	1	389.277	2.964	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)OCCO2	ZINC000476246527	564332369	/nfs/dbraw/zinc/33/23/69/564332369.db2.gz	IWKRDJXDWVLXCK-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000477395634	564374728	/nfs/dbraw/zinc/37/47/28/564374728.db2.gz	HSOAWIIRGCDKIB-UHFFFAOYSA-N	-3	1	381.431	2.914	20	0		GFADML
Cc1c(Br)ccc(C(=O)[O-])c1[N-]S(=O)(=O)c1cccc(N)c1	ZINC000547608328	564501438	/nfs/dbraw/zinc/50/14/38/564501438.db2.gz	BWOARYNRPTWIQB-UHFFFAOYSA-N	-2	1	385.239	2.839	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)[O-])ccc1F	ZINC000547883518	564515910	/nfs/dbraw/zinc/51/59/10/564515910.db2.gz	TZMJIIPOESCKJS-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
COC(=O)c1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1F	ZINC000484570063	564590876	/nfs/dbraw/zinc/59/08/76/564590876.db2.gz	KMJYRZKZCAZTBV-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cc(F)ccc1F)Cc1cccc(Cl)c1	ZINC000573629290	564646874	/nfs/dbraw/zinc/64/68/74/564646874.db2.gz	DSJPDBHKCXFMBG-LLVKDONJSA-N	-2	1	389.807	2.840	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cccc(C[S@@](C)=O)c2)c1C	ZINC000524549827	564682391	/nfs/dbraw/zinc/68/23/91/564682391.db2.gz	REDBGTGELMJUQU-XMMPIXPASA-N	-2	1	381.475	2.681	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000460827640	564780904	/nfs/dbraw/zinc/78/09/04/564780904.db2.gz	KPBXVSDEZIDWFI-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
O=C([O-])Cc1cccc(S(=O)(=O)[N-]c2ccc(-c3csnn3)cc2)c1	ZINC000555124681	564783999	/nfs/dbraw/zinc/78/39/99/564783999.db2.gz	WEFKDVUOGSUDKE-UHFFFAOYSA-N	-2	1	375.431	2.633	20	0		GFADML
COC(=O)c1c(F)ccc([N-]S(=O)(=O)c2cc(C)c(C(=O)[O-])s2)c1F	ZINC000582818085	564863701	/nfs/dbraw/zinc/86/37/01/564863701.db2.gz	ZYXGPHYDXXPNGL-UHFFFAOYSA-N	-2	1	391.373	2.620	20	0		GFADML
O=C([O-])[C@@H](CC1CCC1)[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000530472747	564883758	/nfs/dbraw/zinc/88/37/58/564883758.db2.gz	YEGBSWVWHHNJMK-LLVKDONJSA-N	-2	1	398.225	2.649	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1C	ZINC000466339016	564938165	/nfs/dbraw/zinc/93/81/65/564938165.db2.gz	ZNURHRYUSBXNHF-UHFFFAOYSA-N	-3	1	381.431	2.914	20	0		GFADML
Cc1nc(S(=O)(=O)[N-][C@H](CC(F)F)C(=O)[O-])c(-c2ccccc2)s1	ZINC000663287022	565406290	/nfs/dbraw/zinc/40/62/90/565406290.db2.gz	VKHWDUCTGXFZEL-SNVBAGLBSA-N	-2	1	376.406	2.505	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H]2CCCCCC[C@@H]2C(=O)[O-])c(F)c1	ZINC000681580502	566115912	/nfs/dbraw/zinc/11/59/12/566115912.db2.gz	WGMSJEBEXPTYIX-SMDDNHRTSA-N	-2	1	377.409	2.675	20	0		GFADML
CC(C)(CC(=O)NCc1cccc(-c2ccc(-c3nn[n-]n3)s2)c1)C(=O)[O-]	ZINC000735665466	598885893	/nfs/dbraw/zinc/88/58/93/598885893.db2.gz	XQDDTFBUHLSBMI-UHFFFAOYSA-N	-2	1	385.449	2.712	20	0		GFADML
CCCC[C@@H]1CCC[C@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736986126	599767203	/nfs/dbraw/zinc/76/72/03/599767203.db2.gz	UBPAIOPDFYYSDU-RDTXWAMCSA-N	-2	1	385.464	2.881	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])cc1C(=O)NC(C)C	ZINC000738637262	599908791	/nfs/dbraw/zinc/90/87/91/599908791.db2.gz	VUKZMCAHQJCJQR-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
O=C([O-])[C@@H](CNC(=O)c1cc(Br)ccc1[O-])Cc1cccc(F)c1	ZINC000739406591	599984956	/nfs/dbraw/zinc/98/49/56/599984956.db2.gz	BPUGADJRIGCMET-LLVKDONJSA-N	-2	1	396.212	2.967	20	0		GFADML
O=C([O-])c1sccc1NC(=O)CSc1nc(C(F)(F)F)cc(=O)[n-]1	ZINC000739339241	600120499	/nfs/dbraw/zinc/12/04/99/600120499.db2.gz	ZMHXSYXQMSMEME-UHFFFAOYSA-N	-2	1	379.341	2.692	20	0		GFADML
COC(=O)N(C)Cc1ccc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])cc1	ZINC000737632441	600300596	/nfs/dbraw/zinc/30/05/96/600300596.db2.gz	UNFQFYQESIGZRO-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
O=C([O-])c1ccnc(NC(=O)c2ccc([N-]S(=O)(=O)c3ccccc3)cc2)c1	ZINC000740245621	600428230	/nfs/dbraw/zinc/42/82/30/600428230.db2.gz	UOIXXAGYHDNGRI-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2NC(C)=O)cc1C(=O)[O-]	ZINC000592006969	600545111	/nfs/dbraw/zinc/54/51/11/600545111.db2.gz	SESSZCRJXCFCJI-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
COC(=O)c1cc2cc([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)ccc2o1	ZINC000481978879	600626712	/nfs/dbraw/zinc/62/67/12/600626712.db2.gz	ISUWZQKNQCJLQQ-UHFFFAOYSA-N	-2	1	389.385	2.647	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)c(C(=O)[O-])cc1OC	ZINC000607611121	600886988	/nfs/dbraw/zinc/88/69/88/600886988.db2.gz	HIJJAUNDOPLLBV-UHFFFAOYSA-N	-2	1	391.323	2.620	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000737821732	600889443	/nfs/dbraw/zinc/88/94/43/600889443.db2.gz	QCCKOELRCNCQHF-UHFFFAOYSA-N	-2	1	385.825	2.864	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)c1	ZINC000506644763	600891504	/nfs/dbraw/zinc/89/15/04/600891504.db2.gz	DMYUPAHXTAAOBD-UHFFFAOYSA-N	-2	1	377.422	2.635	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)c1C	ZINC000525330337	600899339	/nfs/dbraw/zinc/89/93/39/600899339.db2.gz	VAUGKIFBPBKIIW-UHFFFAOYSA-N	-2	1	391.445	2.945	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)n(-c2ccncc2)n1	ZINC000832898911	600988337	/nfs/dbraw/zinc/98/83/37/600988337.db2.gz	YIULVRGHMFGGDE-UHFFFAOYSA-N	-2	1	392.824	2.728	20	0		GFADML
CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc(C(=O)NCC(=O)[O-])cc1	ZINC000460445454	601045454	/nfs/dbraw/zinc/04/54/54/601045454.db2.gz	DTGUULKQPKIEST-UHFFFAOYSA-N	-2	1	390.461	2.599	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000751141146	601234781	/nfs/dbraw/zinc/23/47/81/601234781.db2.gz	CRTBWKSGNANFCZ-UHFFFAOYSA-N	-2	1	383.397	2.740	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)c1	ZINC000507987681	601234939	/nfs/dbraw/zinc/23/49/39/601234939.db2.gz	YXJNXLHJLLWDGZ-UHFFFAOYSA-N	-2	1	379.434	2.909	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)ccc1F	ZINC000831326894	601320427	/nfs/dbraw/zinc/32/04/27/601320427.db2.gz	BOIKLELLBBZMPG-WTKPLQERSA-N	-2	1	379.365	2.511	20	0		GFADML
Cc1ccc(C(=O)N(C)C)cc1[N-]S(=O)(=O)c1ccc(/C=C/C(=O)[O-])cc1	ZINC000832911838	601324085	/nfs/dbraw/zinc/32/40/85/601324085.db2.gz	QMINOFDCOXPWLS-YRNVUSSQSA-N	-2	1	388.445	2.595	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2cc(OC)ccc2C(=O)[O-])c1	ZINC000476423632	601330755	/nfs/dbraw/zinc/33/07/55/601330755.db2.gz	NQXQQVHNRYIPGN-UHFFFAOYSA-N	-2	1	393.417	2.598	20	0		GFADML
CC(=O)N1CCCc2cc(S(=O)(=O)[N-]c3cc(C(=O)[O-])ccc3C)ccc21	ZINC000013306671	601357512	/nfs/dbraw/zinc/35/75/12/601357512.db2.gz	DSUYFEBBQMGZOA-UHFFFAOYSA-N	-2	1	388.445	2.793	20	0		GFADML
CCN(CC)c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cn1	ZINC000829687200	601360131	/nfs/dbraw/zinc/36/01/31/601360131.db2.gz	IDXIXDLJQXHDFR-KPKJPENVSA-N	-2	1	375.450	2.826	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2ccc3c(c2)CC(C)(C)O3)c1	ZINC000832182136	601830748	/nfs/dbraw/zinc/83/07/48/601830748.db2.gz	AAQBDGRROWJMEW-UHFFFAOYSA-N	-2	1	377.418	2.908	20	0		GFADML
CC1(C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(F)cc3C(=O)[O-])cc21	ZINC000531775993	601835494	/nfs/dbraw/zinc/83/54/94/601835494.db2.gz	PTHAXWLFNWMJBD-UHFFFAOYSA-N	-2	1	378.381	2.554	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)ccc1Cl	ZINC000751146532	601838619	/nfs/dbraw/zinc/83/86/19/601838619.db2.gz	VPOJEXDTJKUMQK-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
CC(C)c1cc([N-]S(=O)(=O)c2cc(Br)cc(C(=O)[O-])c2)[nH]n1	ZINC000827112776	601850911	/nfs/dbraw/zinc/85/09/11/601850911.db2.gz	QEBWURAGSJNWBD-UHFFFAOYSA-N	-2	1	388.243	2.795	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(-n2cccn2)c(F)c1	ZINC000833295010	601860487	/nfs/dbraw/zinc/86/04/87/601860487.db2.gz	QRFDTRBDPJXPKI-UHFFFAOYSA-N	-2	1	379.344	2.650	20	0		GFADML
C[C@@H](CC(=O)[O-])C(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(F)c(F)c2)cc1	ZINC000827310494	602073339	/nfs/dbraw/zinc/07/33/39/602073339.db2.gz	JVFRMFPTLOBEHZ-JTQLQIEISA-N	-2	1	398.387	2.815	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CCC(=O)Nc1cccc(CC(=O)[O-])c1	ZINC000532695114	602076211	/nfs/dbraw/zinc/07/62/11/602076211.db2.gz	UXDAAGRVXZYQCO-UHFFFAOYSA-N	-2	1	392.415	2.751	20	0		GFADML
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(F)c3)cc2C[C@@H]1C	ZINC000533628155	602321808	/nfs/dbraw/zinc/32/18/08/602321808.db2.gz	IJCMCJMLMXGDJT-JTQLQIEISA-N	-2	1	392.408	2.622	20	0		GFADML
CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000739305120	602856982	/nfs/dbraw/zinc/85/69/82/602856982.db2.gz	LNHQNHGXXDUUCC-QWHCGFSZSA-N	-2	1	377.441	2.639	20	0		GFADML
COc1cccc(N2CC[C@H](CNC(=O)c3ccc(NC(=O)[O-])cc3[O-])C2)c1	ZINC000739951655	602858770	/nfs/dbraw/zinc/85/87/70/602858770.db2.gz	UNTKPUKZXZJCQG-CYBMUJFWSA-N	-2	1	385.420	2.747	20	0		GFADML
CC(C)(C)OC(=O)NC[C@H]1CCC[C@@H]1NC(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000823816905	603909943	/nfs/dbraw/zinc/90/99/43/603909943.db2.gz	GSHLRQIRLLIPAR-RISCZKNCSA-N	-2	1	393.440	2.905	20	0		GFADML
O=C([O-])N1CCc2c1cccc2[N-]S(=O)(=O)c1ccc2oc(=O)ccc2c1	ZINC000832079498	604015686	/nfs/dbraw/zinc/01/56/86/604015686.db2.gz	JLOKQGTYNXSRPS-UHFFFAOYSA-N	-2	1	386.385	2.634	20	0		GFADML
Cc1nc(C2([N-]S(=O)(=O)c3cc(C(=O)[O-])oc3C)CCCCCC2)no1	ZINC000574689177	604506283	/nfs/dbraw/zinc/50/62/83/604506283.db2.gz	ZWPBLBJMJMPJHS-UHFFFAOYSA-N	-2	1	383.426	2.506	20	0		GFADML
O=C([O-])C[C@H]1CCCN1C(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000262914711	604592718	/nfs/dbraw/zinc/59/27/18/604592718.db2.gz	JYBJSJAYFNEVRJ-MRXNPFEDSA-N	-2	1	388.445	2.567	20	0		GFADML
CC(C)N(CCC(=O)[O-])C(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1[O-]	ZINC000833496562	604711645	/nfs/dbraw/zinc/71/16/45/604711645.db2.gz	BTRRWBSAZHMBRR-UHFFFAOYSA-N	-2	1	392.330	2.828	20	0		GFADML
CC(C)(CC(=O)[O-])NC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-]	ZINC000833456265	604714909	/nfs/dbraw/zinc/71/49/09/604714909.db2.gz	QJTVSTAAHDZGNA-UHFFFAOYSA-N	-2	1	392.358	2.906	20	0		GFADML
O=C([O-])[C@@H](NC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-])C1CC1	ZINC000833768884	604722086	/nfs/dbraw/zinc/72/20/86/604722086.db2.gz	QKYCPFMMVBNGBR-INIZCTEOSA-N	-2	1	390.342	2.516	20	0		GFADML
CCC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(OCCC(=O)[O-])cc2)c1	ZINC000504688529	604790649	/nfs/dbraw/zinc/79/06/49/604790649.db2.gz	ZIUJRCFOQAGLLX-UHFFFAOYSA-N	-2	1	377.418	2.934	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)Nc3cncc4ccccc43)cc2)[n-]1	ZINC000833775331	604836855	/nfs/dbraw/zinc/83/68/55/604836855.db2.gz	DJORAFCXLVSDDL-UHFFFAOYSA-N	-2	1	388.383	2.593	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(CC(C)(C)C)n[nH]2)c(OC)c1C(=O)[O-]	ZINC000833734392	604861335	/nfs/dbraw/zinc/86/13/35/604861335.db2.gz	BHQUQXGLMPCUIK-UHFFFAOYSA-N	-2	1	397.453	2.515	20	0		GFADML
CC1(C)CCC(CNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CC1	ZINC000833557750	604864512	/nfs/dbraw/zinc/86/45/12/604864512.db2.gz	ZJOQQTVKPOLQDN-UHFFFAOYSA-N	-2	1	385.464	2.739	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(=O)[O-])c1nc(C2CC2)no1	ZINC000563808667	605024239	/nfs/dbraw/zinc/02/42/39/605024239.db2.gz	XYTFSQQXKRKXLL-CYBMUJFWSA-N	-2	1	399.856	2.974	20	0		GFADML
CC(C)(CNC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CCCC1	ZINC000833459355	605164734	/nfs/dbraw/zinc/16/47/34/605164734.db2.gz	TXKIZVAPHAXCPG-UHFFFAOYSA-N	-2	1	385.464	2.739	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2)c([O-])c1	ZINC000834254249	605631210	/nfs/dbraw/zinc/63/12/10/605631210.db2.gz	BKWSVZPXDMBPCF-AWEZNQCLSA-N	-2	1	387.417	2.636	20	0		GFADML
O=S(=O)([N-]c1ncc(-c2nn[n-]n2)s1)c1ccc(Cl)c2ccccc21	ZINC000823589439	607027323	/nfs/dbraw/zinc/02/73/23/607027323.db2.gz	ZJMUEKQCGIGWMO-UHFFFAOYSA-N	-2	1	392.853	2.931	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000013278845	654503960	/nfs/dbraw/zinc/50/39/60/654503960.db2.gz	SJAHGZHUNHGWCB-UHFFFAOYSA-N	-2	1	380.447	2.866	20	0		GFADML
CSc1cccc([N-]S(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)c1	ZINC000057115626	654800622	/nfs/dbraw/zinc/80/06/22/654800622.db2.gz	YIJWYUQYLHJNEW-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-][N-]C(=O)c2c(Cl)cccc2Cl)c(Cl)n1	ZINC000193325258	655409470	/nfs/dbraw/zinc/40/94/70/655409470.db2.gz	ZHAWMTLIUHMLOJ-UHFFFAOYSA-N	-2	1	394.667	2.974	20	0		GFADML
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(C(=O)[O-])c(C(=O)[O-])c1	ZINC000577820599	655467819	/nfs/dbraw/zinc/46/78/19/655467819.db2.gz	ZJRZPYAACGLYLY-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])sc1Br)C(F)F	ZINC000840889674	661198949	/nfs/dbraw/zinc/19/89/49/661198949.db2.gz	GNXPFLAPCQFDQA-BYPYZUCNSA-N	-2	1	378.216	2.531	20	0		GFADML
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1cccs1	ZINC000776443556	656742032	/nfs/dbraw/zinc/74/20/32/656742032.db2.gz	RYQWBBQIPCNZOF-MRVPVSSYSA-N	-2	1	381.262	2.944	20	0		GFADML
CC[C@@H](C[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000776535683	656753868	/nfs/dbraw/zinc/75/38/68/656753868.db2.gz	CYWGAFHGLRMHLG-YFKPBYRVSA-N	-2	1	376.681	2.553	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)[C@H](O)c1ccccc1	ZINC000776599829	656764975	/nfs/dbraw/zinc/76/49/75/656764975.db2.gz	HKGMCZNPKBYQPV-GHMZBOCLSA-N	-2	1	396.273	2.520	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(OC(F)F)nc2)cc(C(=O)[O-])c1F	ZINC000802723008	659496219	/nfs/dbraw/zinc/49/62/19/659496219.db2.gz	VPNKAOJWJPOATO-UHFFFAOYSA-N	-2	1	376.312	2.630	20	0		GFADML
COc1ccc(C([O-])=CS(=O)(=O)c2ccccc2Cl)c2occ([O-])c21	ZINC000809959331	659953174	/nfs/dbraw/zinc/95/31/74/659953174.db2.gz	HGSGRBXZGZHEKW-UHFFFAOYSA-N	-2	1	380.805	2.580	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC[C@H]1C(F)F	ZINC000868602443	662611563	/nfs/dbraw/zinc/61/15/63/662611563.db2.gz	WSADRVZOYULSHL-NSHDSACASA-N	-2	1	388.417	2.734	20	0		GFADML
COc1cc(Cl)c(S(=O)(=O)[N-][C@H](C2CC2)C(F)(F)F)cc1C(=O)[O-]	ZINC000871964389	662747112	/nfs/dbraw/zinc/74/71/12/662747112.db2.gz	XMGHTMDBOGYRAR-LLVKDONJSA-N	-2	1	387.763	2.666	20	0		GFADML
Cc1cc(S(=O)(=O)Nc2ccc(F)c(NS(C)(=O)=O)c2)c(F)cc1F	ZINC000175764169	552128657	/nfs/dbraw/zinc/12/86/57/552128657.db2.gz	LQBVMCJCUBGSQB-UHFFFAOYSA-N	-2	1	394.396	2.585	20	0		GFADML
C[C@H]1C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(Cl)c3)cc21	ZINC000326791607	563455966	/nfs/dbraw/zinc/45/59/66/563455966.db2.gz	QFWWTNQDMCANQF-MRVPVSSYSA-N	-2	1	380.809	2.895	20	0		GFADML
CNC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)ccc1Cl	ZINC000327904893	563460228	/nfs/dbraw/zinc/46/02/28/563460228.db2.gz	IJQUJVVBOONYTO-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Br)cc1O	ZINC000389423021	563521806	/nfs/dbraw/zinc/52/18/06/563521806.db2.gz	BQKUDBLLXGQIOX-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2C)cc1	ZINC000392784230	563527023	/nfs/dbraw/zinc/52/70/23/563527023.db2.gz	JSOQZBWGTAVHDB-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
CCc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)c(C(=O)[O-])c1	ZINC000410388747	563589274	/nfs/dbraw/zinc/58/92/74/563589274.db2.gz	ZMIYGPICDQSBKQ-UHFFFAOYSA-N	-2	1	382.825	2.500	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])CCS1	ZINC000332309469	563592462	/nfs/dbraw/zinc/59/24/62/563592462.db2.gz	SJSJSIKULVEVTE-LLVKDONJSA-N	-2	1	398.531	2.832	20	0		GFADML
CS[C@H](C)CNC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436499962	563672889	/nfs/dbraw/zinc/67/28/89/563672889.db2.gz	YHZPDEUHRKVWAQ-SNVBAGLBSA-N	-2	1	386.520	2.736	20	0		GFADML
C[C@@H](Sc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1)C(=O)[O-]	ZINC000507567155	564232693	/nfs/dbraw/zinc/23/26/93/564232693.db2.gz	PCZGRQZGRNCIQS-SNVBAGLBSA-N	-3	1	381.431	2.751	20	0		GFADML
COC(=O)c1cc(F)cc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000542931496	564332503	/nfs/dbraw/zinc/33/25/03/564332503.db2.gz	FDFMPTAHQOLLHS-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccccc2C[S@](C)=O)cc(C(=O)[O-])c1C	ZINC000545120602	564408697	/nfs/dbraw/zinc/40/86/97/564408697.db2.gz	PMMNQRUKDBJIPZ-DEOSSOPVSA-N	-2	1	381.475	2.681	20	0		GFADML
C[C@H]([C@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-])C1CC1	ZINC000515872322	564489264	/nfs/dbraw/zinc/48/92/64/564489264.db2.gz	YSEDXTBYSZYBLC-QTTZVWFDSA-N	-2	1	398.225	2.505	20	0		GFADML
N#Cc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2Br)c(F)c1	ZINC000547560627	564493981	/nfs/dbraw/zinc/49/39/81/564493981.db2.gz	AIAJHXZEUVYEGK-UHFFFAOYSA-N	-2	1	399.197	2.959	20	0		GFADML
CC[C@@](C)(C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000547576613	564496577	/nfs/dbraw/zinc/49/65/77/564496577.db2.gz	WXUYYLZXQLNFSU-LBPRGKRZSA-N	-2	1	386.214	2.507	20	0		GFADML
CC(C)(C)[C@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000547594683	564500314	/nfs/dbraw/zinc/50/03/14/564500314.db2.gz	QVMSGVORTVPDDB-SNVBAGLBSA-N	-2	1	386.214	2.505	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])co1)c1nc(C(F)(F)F)cs1	ZINC000577218606	564730214	/nfs/dbraw/zinc/73/02/14/564730214.db2.gz	FNJOYLIMTKCIBP-ZETCQYMHSA-N	-2	1	384.357	2.883	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1csnc1C(=O)[O-])c1ccc(F)cc1F	ZINC000579469260	564747946	/nfs/dbraw/zinc/74/79/46/564747946.db2.gz	XBOMGOGSAOHENN-GFCCVEGCSA-N	-2	1	376.406	2.795	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1csnc1C(=O)[O-])c1ccc(F)cc1F	ZINC000579469263	564748231	/nfs/dbraw/zinc/74/82/31/564748231.db2.gz	XBOMGOGSAOHENN-LBPRGKRZSA-N	-2	1	376.406	2.795	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])cc1	ZINC000460835230	564782065	/nfs/dbraw/zinc/78/20/65/564782065.db2.gz	YPTIXKRMXVCHBL-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCCCCO1	ZINC000530417769	564880849	/nfs/dbraw/zinc/88/08/49/564880849.db2.gz	FWDJIZNMFKPDAX-UHFFFAOYSA-N	-2	1	382.463	2.812	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1cccc(Cl)c1Cl)C(F)(F)F	ZINC000560417491	564960822	/nfs/dbraw/zinc/96/08/22/564960822.db2.gz	ZKRQXYIBWITGNU-ZCFIWIBFSA-N	-2	1	380.171	2.925	20	0		GFADML
COC(=O)[C@@H](C)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)c1	ZINC000560881490	564979492	/nfs/dbraw/zinc/97/94/92/564979492.db2.gz	YHMQUZMWQWMEIX-VIFPVBQESA-N	-2	1	383.447	2.832	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2cc(Br)sc2Cl)CCCC1	ZINC000535498816	565014445	/nfs/dbraw/zinc/01/44/45/565014445.db2.gz	JUHFWUKMWWOCIV-UHFFFAOYSA-N	-2	1	388.692	2.840	20	0		GFADML
O=C([O-])[C@H]1CCCCCC[C@@H]1[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000646030542	565582632	/nfs/dbraw/zinc/58/26/32/565582632.db2.gz	NPLXMBSLENWYSN-JQWIXIFHSA-N	-2	1	380.388	2.802	20	0		GFADML
O=C([O-])CC[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000650420701	565819996	/nfs/dbraw/zinc/81/99/96/565819996.db2.gz	KUXPOGNJABPTOZ-CMPLNLGQSA-N	-2	1	380.388	2.802	20	0		GFADML
O=C([O-])[C@@]1(C[N-]S(=O)(=O)c2sc3ccccc3c2Cl)CCCOC1	ZINC000630432934	565901235	/nfs/dbraw/zinc/90/12/35/565901235.db2.gz	PUSCTSVHFLIMGU-OAHLLOKOSA-N	-2	1	389.882	2.714	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC(C(F)F)C1	ZINC000677916633	565987918	/nfs/dbraw/zinc/98/79/18/565987918.db2.gz	IULAMVKZWLENJC-UHFFFAOYSA-N	-2	1	388.417	2.592	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](C(=O)[O-])C2(C)CCCCC2)c(F)c1	ZINC000681952131	566133328	/nfs/dbraw/zinc/13/33/28/566133328.db2.gz	MHBKRSUITQHOAV-CQSZACIVSA-N	-2	1	377.409	2.675	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc1	ZINC000523186774	599768853	/nfs/dbraw/zinc/76/88/53/599768853.db2.gz	WUBHCTWAMDULPQ-UHFFFAOYSA-N	-2	1	384.417	2.848	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1C(=O)NC(C)C	ZINC000521748672	599908400	/nfs/dbraw/zinc/90/84/00/599908400.db2.gz	JQNOVGRVFFYZQS-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2ccc(F)cc2)c(F)c1	ZINC000737888557	599939425	/nfs/dbraw/zinc/93/94/25/599939425.db2.gz	CFRUCBWLTKTSKR-AWEZNQCLSA-N	-2	1	389.351	2.607	20	0		GFADML
O=C([O-])c1ccc(OCCNC(=O)c2ccc(Br)cc2[O-])cc1	ZINC000740164309	599951387	/nfs/dbraw/zinc/95/13/87/599951387.db2.gz	KHSFEYHURIAJAR-UHFFFAOYSA-N	-2	1	380.194	2.662	20	0		GFADML
CCOC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000737146731	600095704	/nfs/dbraw/zinc/09/57/04/600095704.db2.gz	NOKWYWOXVHPXQM-UHFFFAOYSA-N	-2	1	382.369	2.893	20	0		GFADML
O=C([O-])Nc1cc([N-]S(=O)(=O)c2ccc3c(c2)OCCCO3)ccc1F	ZINC000740013437	600101665	/nfs/dbraw/zinc/10/16/65/600101665.db2.gz	ZBJPRWROGGCEKO-UHFFFAOYSA-N	-2	1	382.369	2.878	20	0		GFADML
CC(C)(C)C1CCN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CC1	ZINC000736248941	600212733	/nfs/dbraw/zinc/21/27/33/600212733.db2.gz	DSWLEWUIUGZISI-UHFFFAOYSA-N	-2	1	385.464	2.691	20	0		GFADML
Cc1nc(-c2ccc(S(=O)(=O)[N-]c3ccc(OCC(=O)[O-])cc3)cc2)co1	ZINC000738829608	600299927	/nfs/dbraw/zinc/29/99/27/600299927.db2.gz	OKHKLRPTFJKOLI-UHFFFAOYSA-N	-2	1	388.401	2.914	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CN(C)C(=O)[O-])cc1	ZINC000738546311	600301304	/nfs/dbraw/zinc/30/13/04/600301304.db2.gz	SGKWGHCWFXNERH-UHFFFAOYSA-N	-3	1	378.406	2.604	20	0		GFADML
C[S@@](=O)Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc(C(=O)[O-])cs2)c1	ZINC000738179039	600302677	/nfs/dbraw/zinc/30/26/77/600302677.db2.gz	GEQRBEOWCCWRTK-JOCHJYFZSA-N	-2	1	393.895	2.779	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCC[C@@]4(CC=CCC4)C3)cc2)[n-]1	ZINC000739877065	600424963	/nfs/dbraw/zinc/42/49/63/600424963.db2.gz	JGTVYUBEAPVLCO-QFIPXVFZSA-N	-2	1	395.459	2.755	20	0		GFADML
CCN(CC)C(=O)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000267117989	600625666	/nfs/dbraw/zinc/62/56/66/600625666.db2.gz	AJQDYHHNWNOEFR-UHFFFAOYSA-N	-2	1	390.461	2.597	20	0		GFADML
O=C([O-])CCc1nnc([N-]C(=O)c2cnc(Cc3ccc(F)cc3)s2)s1	ZINC000739782334	600631962	/nfs/dbraw/zinc/63/19/62/600631962.db2.gz	ZUUJTKMOPMAJIU-UHFFFAOYSA-N	-2	1	392.437	2.994	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc1C(=O)[O-]	ZINC000738063978	600637997	/nfs/dbraw/zinc/63/79/97/600637997.db2.gz	NWHFGWMAZHRJCC-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
O=C([O-])c1cc(Cl)cc([N-]S(=O)(=O)c2cccc(C(=O)NC3CC3)c2)c1	ZINC000740075303	600638375	/nfs/dbraw/zinc/63/83/75/600638375.db2.gz	ISHNMDACVQHKQI-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCC2)cc1C(=O)[O-]	ZINC000738069930	600659173	/nfs/dbraw/zinc/65/91/73/600659173.db2.gz	RTMSSAFASOKKCA-UHFFFAOYSA-N	-2	1	376.434	2.794	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3nc([C@@H]4CCCO4)[nH]c3c2)cs1	ZINC000299292013	600676945	/nfs/dbraw/zinc/67/69/45/600676945.db2.gz	KASWBWPAFHIGHQ-ZDUSSCGKSA-N	-2	1	393.446	2.975	20	0		GFADML
NC(=O)c1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)ccc1Cl	ZINC000739178554	600888362	/nfs/dbraw/zinc/88/83/62/600888362.db2.gz	XVCUJSVOYSJNAU-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)c(C)c1	ZINC000506676028	600890241	/nfs/dbraw/zinc/89/02/41/600890241.db2.gz	SMSUORSOKBAWCY-UHFFFAOYSA-N	-2	1	376.434	2.552	20	0		GFADML
Cn1cc(NC(=O)c2ccc(S(=O)(=O)[N-]c3ccccc3)cc2)cc1C(=O)[O-]	ZINC000833051837	601313374	/nfs/dbraw/zinc/31/33/74/601313374.db2.gz	LADUYSXVXQXDHY-UHFFFAOYSA-N	-2	1	399.428	2.776	20	0		GFADML
Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3ccc(/C=C\C(=O)[O-])cc3)cn2)n1	ZINC000832879773	601323238	/nfs/dbraw/zinc/32/32/38/601323238.db2.gz	JYGOAZVATAVQFM-YHYXMXQVSA-N	-2	1	398.444	2.783	20	0		GFADML
CCOc1cc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)ccc1OC	ZINC000830049650	601325124	/nfs/dbraw/zinc/32/51/24/601325124.db2.gz	LOCWSLTXRJQBQH-IZZDOVSWSA-N	-2	1	377.418	2.993	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1F	ZINC000831779151	601326624	/nfs/dbraw/zinc/32/66/24/601326624.db2.gz	CKXMVRZXCWGBCJ-WTKPLQERSA-N	-2	1	395.408	2.750	20	0		GFADML
COC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)ccc1F	ZINC000066587863	601328362	/nfs/dbraw/zinc/32/83/62/601328362.db2.gz	IEHHGAZVHQAOTJ-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)ccc1C(=O)NC(C)C	ZINC000731178592	601331645	/nfs/dbraw/zinc/33/16/45/601331645.db2.gz	SBIDTMPOTCGZES-UHFFFAOYSA-N	-2	1	394.424	2.771	20	0		GFADML
COc1ccc(CCC(=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000507924006	601488343	/nfs/dbraw/zinc/48/83/43/601488343.db2.gz	ZRXKDMROPARWHL-UHFFFAOYSA-N	-2	1	393.417	2.520	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(CC(=O)[O-])cc1	ZINC000443365679	601575616	/nfs/dbraw/zinc/57/56/16/601575616.db2.gz	KTQNCJFTEBIAJF-UHFFFAOYSA-N	-2	1	393.417	2.602	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)NCC(C)(C)C(=O)[O-])cc2)cc1	ZINC000262274742	601714233	/nfs/dbraw/zinc/71/42/33/601714233.db2.gz	VKILHVDSGVDLGY-UHFFFAOYSA-N	-2	1	390.461	2.636	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCc4c3cccc4Cl)cc2)[n-]1	ZINC000833264636	601751357	/nfs/dbraw/zinc/75/13/57/601751357.db2.gz	FKNCRYYQHBWVIP-UHFFFAOYSA-N	-2	1	397.818	2.649	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)Nc3cccc4ccncc43)cc2)[n-]1	ZINC000833266542	601763721	/nfs/dbraw/zinc/76/37/21/601763721.db2.gz	QFZJYDKQMYKSTC-UHFFFAOYSA-N	-2	1	388.383	2.593	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3cccc(C(=O)[O-])c3)ccc2o1	ZINC000831795947	601795239	/nfs/dbraw/zinc/79/52/39/601795239.db2.gz	UPTGDULUOPMQQK-UHFFFAOYSA-N	-2	1	376.390	2.516	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)ccc1F	ZINC000026235602	601826712	/nfs/dbraw/zinc/82/67/12/601826712.db2.gz	VDQCFUPBMCPFCA-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1C	ZINC000326891158	601826924	/nfs/dbraw/zinc/82/69/24/601826924.db2.gz	IKRRFWRRPFNLGN-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
O=C([O-])c1c[nH]c2cc([N-]S(=O)(=O)c3cc(F)c(F)c(C(=O)[O-])c3)ccc12	ZINC000751141510	601840867	/nfs/dbraw/zinc/84/08/67/601840867.db2.gz	DPDZMWMHTRENEG-UHFFFAOYSA-N	-3	1	396.327	2.643	20	0		GFADML
CC(C)C(=O)Nc1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000826658797	601855904	/nfs/dbraw/zinc/85/59/04/601855904.db2.gz	ZHBHPUSPFLHLST-UHFFFAOYSA-N	-2	1	380.397	2.919	20	0		GFADML
CC(C)CNC(=O)c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000826891419	601859132	/nfs/dbraw/zinc/85/91/32/601859132.db2.gz	PGHIURJGFCZPLA-UHFFFAOYSA-N	-2	1	394.424	2.711	20	0		GFADML
Cc1nc([C@H](C)[N-]S(=O)(=O)c2cc(C(=O)[O-])oc2Br)cs1	ZINC000832993877	602154953	/nfs/dbraw/zinc/15/49/53/602154953.db2.gz	JEHHLLTVYSEVEO-YFKPBYRVSA-N	-2	1	395.256	2.545	20	0		GFADML
Cc1ccc(C(=O)OCC(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cl)c1	ZINC000832919248	602242177	/nfs/dbraw/zinc/24/21/77/602242177.db2.gz	ZYQNWFAESISOGZ-UHFFFAOYSA-N	-2	1	383.809	2.691	20	0		GFADML
CCN(CC)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)cc1	ZINC000532845313	602321344	/nfs/dbraw/zinc/32/13/44/602321344.db2.gz	RYYLMWYJGHXNNP-UHFFFAOYSA-N	-2	1	394.424	2.807	20	0		GFADML
CCC[C@@H](NC(=O)[O-])C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000739324864	602395419	/nfs/dbraw/zinc/39/54/19/602395419.db2.gz	FRJISWRVWTXGAL-MRXNPFEDSA-N	-2	1	391.449	2.862	20	0		GFADML
CCCCNC(=O)c1ccc(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])cc1	ZINC000739333283	602849265	/nfs/dbraw/zinc/84/92/65/602849265.db2.gz	SYGSORCXLROOIX-UHFFFAOYSA-N	-2	1	385.420	2.942	20	0		GFADML
CCC(CC)C(=O)N1CCC(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000739254915	602850817	/nfs/dbraw/zinc/85/08/17/602850817.db2.gz	VWDILSZSAZXUDG-UHFFFAOYSA-N	-2	1	377.441	2.639	20	0		GFADML
C[C@H]1CN(c2ccc(NC(=O)c3ccc(NC(=O)[O-])cc3[O-])cn2)C[C@H](C)O1	ZINC000739192248	602850966	/nfs/dbraw/zinc/85/09/66/602850966.db2.gz	IPSSQENDVGZSET-RYUDHWBXSA-N	-2	1	386.408	2.743	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)c(C)c1	ZINC000828788061	603400374	/nfs/dbraw/zinc/40/03/74/603400374.db2.gz	BUFQMFVWOQUOHZ-LBPRGKRZSA-N	-2	1	392.433	2.911	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC([C@@H]2CCCN2C(=O)[O-])CC1	ZINC000830708496	603480935	/nfs/dbraw/zinc/48/09/35/603480935.db2.gz	BMLUIXFDTSVEOD-AWEZNQCLSA-N	-2	1	376.457	2.609	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC[C@H]([C@H]2CCCN2C(=O)[O-])C1	ZINC000830705161	603480949	/nfs/dbraw/zinc/48/09/49/603480949.db2.gz	XMORWJHJKUEFJB-UONOGXRCSA-N	-2	1	390.484	2.783	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC[C@@H]([C@@H]2CCCN2C(=O)[O-])C1	ZINC000830709542	603481390	/nfs/dbraw/zinc/48/13/90/603481390.db2.gz	LPWXODXPKNYQNV-KGLIPLIRSA-N	-2	1	376.457	2.609	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CCN1C(=O)OC(C)(C)C	ZINC000826035621	603876718	/nfs/dbraw/zinc/87/67/18/603876718.db2.gz	ZZPXDBSAKCCRAF-LLVKDONJSA-N	-2	1	379.413	2.564	20	0		GFADML
CN(Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)N(C)CC2)C(=O)[O-]	ZINC000828400308	603877607	/nfs/dbraw/zinc/87/76/07/603877607.db2.gz	WUHXANTUTSEVQP-UHFFFAOYSA-N	-2	1	375.450	2.590	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(OC[C@H]3CCCCO3)CC2)c([O-])c1	ZINC000832829184	604068847	/nfs/dbraw/zinc/06/88/47/604068847.db2.gz	OXCCJXSPFGRHNN-OAHLLOKOSA-N	-2	1	378.425	2.672	20	0		GFADML
CC(C)COC[C@H]([N-]S(=O)(=O)c1ccc(F)cc1C(=O)[O-])c1ccco1	ZINC000833487750	604685304	/nfs/dbraw/zinc/68/53/04/604685304.db2.gz	HGQUSSQQRKEODS-AWEZNQCLSA-N	-2	1	385.413	2.809	20	0		GFADML
CN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])[C@@H]1CCN(C(=O)[O-])C1	ZINC000827938255	604921197	/nfs/dbraw/zinc/92/11/97/604921197.db2.gz	HTYJDNXBNVOEBZ-GFCCVEGCSA-N	-2	1	379.413	2.564	20	0		GFADML
O=C([O-])N1CC[C@@H](C[N-]S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)C1	ZINC000834076828	605425830	/nfs/dbraw/zinc/42/58/30/605425830.db2.gz	CXWQJAYZNRJDQH-QMMMGPOBSA-N	-2	1	386.779	2.637	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c([O-])c1	ZINC000834258284	605650309	/nfs/dbraw/zinc/65/03/09/605650309.db2.gz	OCVJYGMJMCRZKG-MRXNPFEDSA-N	-2	1	384.388	2.830	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)c([O-])c1	ZINC000834258435	605655822	/nfs/dbraw/zinc/65/58/22/605655822.db2.gz	PRISFICCCWFKDF-HNNXBMFYSA-N	-2	1	384.388	2.596	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)OCc2cc(C(=O)[O-])ccc2F)o1	ZINC000833430700	605810557	/nfs/dbraw/zinc/81/05/57/605810557.db2.gz	HFRXFEYNVPPMIH-UHFFFAOYSA-N	-2	1	399.396	2.551	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])[C@@H](C)CN1C(=O)OC(C)(C)C	ZINC000833836324	605837200	/nfs/dbraw/zinc/83/72/00/605837200.db2.gz	NDAAHHRLXIWCNP-NWDGAFQWSA-N	-2	1	393.440	2.952	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1sccc1Br)C1CCCCC1	ZINC000049060851	654714537	/nfs/dbraw/zinc/71/45/37/654714537.db2.gz	FQJSCJHSRYSVIQ-SNVBAGLBSA-N	-2	1	382.301	2.822	20	0		GFADML
O=C([N-][N-]S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NC1CCCC1	ZINC000065833091	654888804	/nfs/dbraw/zinc/88/88/04/654888804.db2.gz	SUIRAJLKNNPERL-UHFFFAOYSA-N	-2	1	385.795	2.794	20	0		GFADML
CCC(=O)C[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)[O-]	ZINC000275065944	655214973	/nfs/dbraw/zinc/21/49/73/655214973.db2.gz	VNDDMRQDYLVRFE-SNVBAGLBSA-N	-2	1	388.656	2.748	20	0		GFADML
O=C([O-])[C@@H](C[C@H]1CCOC1)[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000577356160	655457553	/nfs/dbraw/zinc/45/75/53/655457553.db2.gz	BTVGEYUPKNCPOK-MWLCHTKSSA-N	-2	1	389.882	2.713	20	0		GFADML
CSCC[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Cl)C(=O)[O-]	ZINC000578657674	655483934	/nfs/dbraw/zinc/48/39/34/655483934.db2.gz	ULFXGVWXHIZXHA-SECBINFHSA-N	-2	1	376.258	2.617	20	0		GFADML
CC(=O)Nc1ccc(Cl)c([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2F)c1	ZINC000745978569	655757165	/nfs/dbraw/zinc/75/71/65/655757165.db2.gz	XUNNRBYAWCFOFW-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
C[C@H]1CCCC[C@@H]1OCC[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F	ZINC000761262525	656005983	/nfs/dbraw/zinc/00/59/83/656005983.db2.gz	FSFCUSPZUYITHJ-GWCFXTLKSA-N	-2	1	377.409	2.537	20	0		GFADML
CC(C)(C)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)[nH]n1	ZINC000761906529	656024110	/nfs/dbraw/zinc/02/41/10/656024110.db2.gz	CTLOWNFIWZODKY-UHFFFAOYSA-N	-2	1	375.809	2.999	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccccc2C[S@@](C)=O)cc(C(=O)[O-])c1F	ZINC000762453803	656042774	/nfs/dbraw/zinc/04/27/74/656042774.db2.gz	PKUMLFDZSYHBMH-XMMPIXPASA-N	-2	1	385.438	2.512	20	0		GFADML
Cc1csc([C@@H](C)C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)n1	ZINC000871939361	662744012	/nfs/dbraw/zinc/74/40/12/662744012.db2.gz	AGKMYCUWQGASLF-ZETCQYMHSA-N	-2	1	376.406	2.510	20	0		GFADML
Cc1cc(S(=O)(=O)[N-][C@H](C[C@@H]2CCCO2)C(F)(F)F)sc1C(=O)[O-]	ZINC000871979727	662748592	/nfs/dbraw/zinc/74/85/92/662748592.db2.gz	SCRANXCFRMFUJM-DTWKUNHWSA-N	-2	1	387.401	2.533	20	0		GFADML
O=S(=O)([N-]c1cnn2c1CCCC2)c1c([O-])cccc1OC(F)(F)F	ZINC000901944596	663751783	/nfs/dbraw/zinc/75/17/83/663751783.db2.gz	JJRALZMNNKINEL-UHFFFAOYSA-N	-2	1	377.344	2.624	20	0		GFADML
C[C@]1(C(=O)[O-])C[C@H]([N-]S(=O)(=O)c2sc3ccccc3c2Cl)CCO1	ZINC000906011275	663908464	/nfs/dbraw/zinc/90/84/64/663908464.db2.gz	RHCXHZCCQAYVMJ-RFAUZJTJSA-N	-2	1	389.882	2.855	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(C(=O)[O-])c(Cl)c1	ZINC000146187679	551396900	/nfs/dbraw/zinc/39/69/00/551396900.db2.gz	XSNGARXOZIMQDF-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(F)cc2[N-]S(C)(=O)=O)cc(C)c1F	ZINC000179765445	552202625	/nfs/dbraw/zinc/20/26/25/552202625.db2.gz	ZNXOXESTERYOCH-UHFFFAOYSA-N	-2	1	390.433	2.754	20	0		GFADML
CC(C)C[C@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000261755627	553158101	/nfs/dbraw/zinc/15/81/01/553158101.db2.gz	WWJKTYCLQFIRCD-LURJTMIESA-N	-2	1	390.708	2.942	20	0		GFADML
CS(=O)(=O)[N-]c1cc(F)ccc1[N-]S(=O)(=O)c1ccc(C2CC2)cc1	ZINC000295186049	563233919	/nfs/dbraw/zinc/23/39/19/563233919.db2.gz	JYLJLUSOIYBTGO-UHFFFAOYSA-N	-2	1	384.454	2.875	20	0		GFADML
COc1cccc(S(=O)(=O)[N-]c2cc(Br)cc(C(=O)[O-])c2)c1	ZINC000316731072	563441432	/nfs/dbraw/zinc/44/14/32/563441432.db2.gz	GSJXWACBZSOHBL-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)COC3)cc1Br	ZINC000507001924	564215241	/nfs/dbraw/zinc/21/52/41/564215241.db2.gz	MJARZUOYXDZUSI-UHFFFAOYSA-N	-2	1	398.234	2.978	20	0		GFADML
CC(C)(CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000566654996	564336551	/nfs/dbraw/zinc/33/65/51/564336551.db2.gz	OBAGULGEXWBREF-UHFFFAOYSA-N	-2	1	376.681	2.696	20	0		GFADML
CCc1ccc(S(=O)(=O)[N-]c2ccccc2C[S@](C)=O)cc1C(=O)[O-]	ZINC000546538482	564458219	/nfs/dbraw/zinc/45/82/19/564458219.db2.gz	KAMXHBWTKDVLOE-DEOSSOPVSA-N	-2	1	381.475	2.627	20	0		GFADML
C[C@H](CCC[C@H](C)[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)[O-]	ZINC000547609071	564501530	/nfs/dbraw/zinc/50/15/30/564501530.db2.gz	MPUZBGFPUAQHJS-ZJUUUORDSA-N	-2	1	378.834	2.806	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cc(F)ccc1F)Cc1ccc(Cl)cc1	ZINC000547881876	564515893	/nfs/dbraw/zinc/51/58/93/564515893.db2.gz	GNYXHJBNSRRJIP-LLVKDONJSA-N	-2	1	389.807	2.840	20	0		GFADML
Cc1cc(F)cc(C)c1S(=O)(=O)[N-]c1ccc(F)cc1[N-]S(C)(=O)=O	ZINC000485395178	564613419	/nfs/dbraw/zinc/61/34/19/564613419.db2.gz	MAEYMSGZUMBJAM-UHFFFAOYSA-N	-2	1	390.433	2.754	20	0		GFADML
COC(=O)Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000580865874	564777713	/nfs/dbraw/zinc/77/77/13/564777713.db2.gz	VJMNIUPPHTYMNS-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2)cc1Cl	ZINC000500329262	564950372	/nfs/dbraw/zinc/95/03/72/564950372.db2.gz	NFOLVTRPMNTDBE-UHFFFAOYSA-N	-2	1	377.752	2.882	20	0		GFADML
CNC(=O)c1ccc(S(=O)(=O)[N-]c2c(C)c(Cl)ccc2C(=O)[O-])cc1	ZINC000618761977	565314361	/nfs/dbraw/zinc/31/43/61/565314361.db2.gz	YWIKIBPRZSRCQW-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
CSc1ccc(S(=O)(=O)[N-]c2ccc(NC(C)=O)cc2C(=O)[O-])cc1	ZINC000681558895	566112358	/nfs/dbraw/zinc/11/23/58/566112358.db2.gz	VZCQBAZATXAXDQ-UHFFFAOYSA-N	-2	1	380.447	2.866	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]C[C@@]2(CC(=O)[O-])CC[C@H](C)C2)c(F)c1	ZINC000681581184	566115630	/nfs/dbraw/zinc/11/56/30/566115630.db2.gz	XSDJLKJGAVVQNO-QFYYESIMSA-N	-2	1	377.409	2.533	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(Cl)c2F)c(C(=O)[O-])s1	ZINC000737680329	599813823	/nfs/dbraw/zinc/81/38/23/599813823.db2.gz	HQYMUSWUALLMAB-UHFFFAOYSA-N	-2	1	393.801	2.826	20	0		GFADML
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3cccc(F)c3C(=O)[O-])cc2C[C@@H]1C	ZINC000140576556	599851601	/nfs/dbraw/zinc/85/16/01/599851601.db2.gz	HFILDGFLBVNJPJ-JTQLQIEISA-N	-2	1	392.408	2.622	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1F	ZINC000477407064	599907027	/nfs/dbraw/zinc/90/70/27/599907027.db2.gz	SPGMJLZZNATWFG-UHFFFAOYSA-N	-2	1	383.397	2.658	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@@H](CCC(=O)[O-])c2ccccc2)c(=O)[n-]1	ZINC000738210272	599934694	/nfs/dbraw/zinc/93/46/94/599934694.db2.gz	REMUPWRBGDRBNU-HNNXBMFYSA-N	-2	1	389.477	2.867	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)cc1NC(C)=O	ZINC000738064098	600101047	/nfs/dbraw/zinc/10/10/47/600101047.db2.gz	RWUXDVLGTGUPKC-UHFFFAOYSA-N	-2	1	397.384	2.683	20	0		GFADML
CCN(C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)[C@@H]1CCCC[C@H]1C	ZINC000737059053	600121048	/nfs/dbraw/zinc/12/10/48/600121048.db2.gz	ZGCCNNZREBAFNX-RDTXWAMCSA-N	-2	1	385.464	2.834	20	0		GFADML
O=C([O-])c1c[nH]c2cc([N-]S(=O)(=O)c3cc(F)ccc3C(=O)[O-])ccc12	ZINC000740145426	600237042	/nfs/dbraw/zinc/23/70/42/600237042.db2.gz	RLEDVSIMGGITLI-UHFFFAOYSA-N	-3	1	378.337	2.504	20	0		GFADML
O=C([O-])c1sccc1S(=O)(=O)[N-]c1ccc(O[C@H]2CCCC[C@H]2O)cc1	ZINC000740291319	600245384	/nfs/dbraw/zinc/24/53/84/600245384.db2.gz	ZSZYZAPWDFKZQV-KGLIPLIRSA-N	-2	1	397.474	2.929	20	0		GFADML
C=CCNC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000063180365	600482902	/nfs/dbraw/zinc/48/29/02/600482902.db2.gz	CTLBAGRACOKPHO-UHFFFAOYSA-N	-2	1	394.836	2.755	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])cc1Cl	ZINC000737700393	600483233	/nfs/dbraw/zinc/48/32/33/600483233.db2.gz	SMMZMKWYIADXFZ-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CCOCCCN(C[C@H](C)C(=O)[O-])C(=O)c1cc(Br)ccc1[O-]	ZINC000737167880	600484995	/nfs/dbraw/zinc/48/49/95/600484995.db2.gz	IFGSATDWLIVCSI-NSHDSACASA-N	-2	1	388.258	2.744	20	0		GFADML
CCCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000737029783	600626151	/nfs/dbraw/zinc/62/61/51/600626151.db2.gz	MQWFBOLVYWPPKA-UHFFFAOYSA-N	-2	1	377.418	2.681	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2N(C)C)cc1C(=O)[O-]	ZINC000326994794	600659037	/nfs/dbraw/zinc/65/90/37/600659037.db2.gz	NUXGYXGHPBCAAO-UHFFFAOYSA-N	-2	1	384.841	2.914	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)NC(C)(C)CC(=O)[O-])c2)cc1	ZINC000738637128	600790031	/nfs/dbraw/zinc/79/00/31/600790031.db2.gz	VDXHVHGZXWNVTQ-UHFFFAOYSA-N	-2	1	390.461	2.779	20	0		GFADML
Cc1ccc(C(=O)NC2CC2)cc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000284964367	600888854	/nfs/dbraw/zinc/88/88/54/600888854.db2.gz	CREFHRMGKHEZFM-UHFFFAOYSA-N	-2	1	388.445	2.695	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000737605038	600893287	/nfs/dbraw/zinc/89/32/87/600893287.db2.gz	MXJGXNCASFANIB-UHFFFAOYSA-N	-2	1	397.836	2.945	20	0		GFADML
COC(=O)C(C)(C)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000267222491	600898668	/nfs/dbraw/zinc/89/86/68/600898668.db2.gz	UVGOVEWDSKROJH-UHFFFAOYSA-N	-2	1	391.445	2.565	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc([S@](=O)C(F)(F)F)cc2)cc1	ZINC000748676215	601127021	/nfs/dbraw/zinc/12/70/21/601127021.db2.gz	YGDWVPUTHAYLIQ-DEOSSOPVSA-N	-2	1	393.364	2.813	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3ccc(C(=O)[O-])c(C)c3)ccc2o1	ZINC000831831815	601230337	/nfs/dbraw/zinc/23/03/37/601230337.db2.gz	QFTTZLRZJFSRSS-UHFFFAOYSA-N	-2	1	376.390	2.782	20	0		GFADML
CC[C@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000057121444	601325745	/nfs/dbraw/zinc/32/57/45/601325745.db2.gz	BQDVIISMQWUKSF-NSHDSACASA-N	-2	1	394.424	2.853	20	0		GFADML
CCCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1	ZINC000829519531	601326065	/nfs/dbraw/zinc/32/60/65/601326065.db2.gz	LQPBGVBYBADEOZ-LFYBBSHMSA-N	-2	1	388.445	2.725	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(N3CCOC3=O)cc2)c1C	ZINC000832868515	601326798	/nfs/dbraw/zinc/32/67/98/601326798.db2.gz	XMEQKTTVJCKGBU-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)ccc1F	ZINC000747618975	601333025	/nfs/dbraw/zinc/33/30/25/601333025.db2.gz	SLLVKBMOXOSDGL-UHFFFAOYSA-N	-2	1	395.408	2.775	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000829799063	601828861	/nfs/dbraw/zinc/82/88/61/601828861.db2.gz	AWBXLPGBTWJSPO-UHFFFAOYSA-N	-2	1	397.840	2.980	20	0		GFADML
Cc1cc(F)cc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1	ZINC000832887702	601829452	/nfs/dbraw/zinc/82/94/52/601829452.db2.gz	YVKNYHFWYONKNL-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])NCCC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1	ZINC000739946823	602025403	/nfs/dbraw/zinc/02/54/03/602025403.db2.gz	KZTRERSRXGFBKI-UHFFFAOYSA-N	-2	1	397.840	2.737	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)Nc2cc(Cl)cc(C(=O)[O-])c2)ccc1[O-]	ZINC000825890851	602199739	/nfs/dbraw/zinc/19/97/39/602199739.db2.gz	YOMNQEWSQIQGIT-UHFFFAOYSA-N	-2	1	384.797	2.503	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)OCCNC(=O)[O-])c1	ZINC000832979103	602257741	/nfs/dbraw/zinc/25/77/41/602257741.db2.gz	HLLKCQBWTIEAOB-UHFFFAOYSA-N	-2	1	392.433	2.529	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cc(CCc3ccccc3)n[nH]2)s1	ZINC000833323646	602309103	/nfs/dbraw/zinc/30/91/03/602309103.db2.gz	WKARUTMNFBRKKN-UHFFFAOYSA-N	-2	1	377.447	2.755	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1F	ZINC000831435060	602320887	/nfs/dbraw/zinc/32/08/87/602320887.db2.gz	MUFIXZWFNFUZTR-RUDMXATFSA-N	-2	1	379.365	2.511	20	0		GFADML
CC(C)C[C@@H](NC(=O)[O-])c1noc([C@@H](C)[N-]S(=O)(=O)c2cccs2)n1	ZINC000738817944	602408459	/nfs/dbraw/zinc/40/84/59/602408459.db2.gz	VTDNQHUCAIUSOK-NXEZZACHSA-N	-2	1	388.471	2.525	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)ccc1NC(=O)[O-]	ZINC000739867493	602645601	/nfs/dbraw/zinc/64/56/01/602645601.db2.gz	BSCPOAKGDUTOEQ-UHFFFAOYSA-N	-3	1	386.407	2.654	20	0		GFADML
O=C([O-])NCc1nc(C(=O)[N-]c2nc(-c3ccc(F)cc3)ns2)cs1	ZINC000740686364	602733334	/nfs/dbraw/zinc/73/33/34/602733334.db2.gz	XRJAMQVTIWVMAM-UHFFFAOYSA-N	-2	1	379.398	2.821	20	0		GFADML
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738706876	602855644	/nfs/dbraw/zinc/85/56/44/602855644.db2.gz	GWMOQFVPGBFSCM-LBPRGKRZSA-N	-2	1	393.440	2.859	20	0		GFADML
CC(C)[C@@H](CNC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])NC(=O)[O-]	ZINC000738792842	602864798	/nfs/dbraw/zinc/86/47/98/602864798.db2.gz	ZNTWBGVRFUGTLL-CYBMUJFWSA-N	-2	1	381.429	2.761	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc([C@H](C)NC(=O)[O-])cc1	ZINC000830957216	603404283	/nfs/dbraw/zinc/40/42/83/603404283.db2.gz	MNGMBJGAEXGWTO-QMMMGPOBSA-N	-3	1	384.435	2.884	20	0		GFADML
CC(C)(C[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)NC(=O)[O-]	ZINC000824011688	603470238	/nfs/dbraw/zinc/47/02/38/603470238.db2.gz	ZIGUNGUEPOMWGZ-UHFFFAOYSA-N	-2	1	375.661	2.971	20	0		GFADML
O=C([O-])CCC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])cc2)cc1	ZINC000831816090	603502632	/nfs/dbraw/zinc/50/26/32/603502632.db2.gz	ZIJYDADQRANSBL-UHFFFAOYSA-N	-3	1	392.389	2.625	20	0		GFADML
CCc1cc2c(COC(=O)[C@@H]3CCC[C@@H](NC(=O)[O-])C3)cc(=O)oc2cc1[O-]	ZINC000827568476	603872826	/nfs/dbraw/zinc/87/28/26/603872826.db2.gz	BXQOQUPNYROWSW-TZMCWYRMSA-N	-2	1	389.404	2.931	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2cc3c(cc2NC(=O)[O-])OCO3)cc1	ZINC000827445205	603887464	/nfs/dbraw/zinc/88/74/64/603887464.db2.gz	XTKZOMBPTFDRGV-UHFFFAOYSA-N	-2	1	380.378	2.705	20	0		GFADML
Cc1nc(-c2ccc(NC[C@H]3[C@H](C)OC(C)(C)N3C(=O)[O-])nc2)[n-]c(=O)c1C	ZINC000830685618	604020086	/nfs/dbraw/zinc/02/00/86/604020086.db2.gz	ITAVDOJXZQZBAM-JSGCOSHPSA-N	-2	1	387.440	2.776	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])cc(C(=O)[O-])c1C	ZINC000830137534	604427581	/nfs/dbraw/zinc/42/75/81/604427581.db2.gz	CIWXSWFVXFIZDM-UHFFFAOYSA-N	-3	1	390.417	2.843	20	0		GFADML
O=C([O-])C1(NC(=O)c2ccc(NC(=O)c3cc(F)cc(F)c3)cc2[O-])CCC1	ZINC000833768650	604737464	/nfs/dbraw/zinc/73/74/64/604737464.db2.gz	IEWFWVCHVUKMKY-UHFFFAOYSA-N	-2	1	390.342	2.660	20	0		GFADML
CC(C)NC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(F)cc2C(=O)[O-])cc1	ZINC000833503050	604745032	/nfs/dbraw/zinc/74/50/32/604745032.db2.gz	KXFMYFQZQLMSCR-UHFFFAOYSA-N	-2	1	395.412	2.855	20	0		GFADML
CC(C)n1ncc2cc(S(=O)(=O)[N-]c3cccc(OCC(=O)[O-])c3)ccc21	ZINC000827207145	604767374	/nfs/dbraw/zinc/76/73/74/604767374.db2.gz	LQFCWNIFLKEMJU-UHFFFAOYSA-N	-2	1	389.433	2.881	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCCC34CCCCC4)cc2)[n-]1	ZINC000833776045	604880293	/nfs/dbraw/zinc/88/02/93/604880293.db2.gz	PVNZZDZVGQTXBS-UHFFFAOYSA-N	-2	1	383.448	2.732	20	0		GFADML
COC(=O)C1(c2ccc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])cc3)cc2)CC1	ZINC000833702102	605124901	/nfs/dbraw/zinc/12/49/01/605124901.db2.gz	ONXRZADQUPPJLX-UHFFFAOYSA-N	-2	1	390.417	2.782	20	0		GFADML
O=C([O-])N1CCC(N(C(=O)c2ccc(Br)cc2[O-])C2CC2)CC1	ZINC000834082276	605645265	/nfs/dbraw/zinc/64/52/65/605645265.db2.gz	JRXHGBFIZDQDDA-UHFFFAOYSA-N	-2	1	383.242	2.902	20	0		GFADML
Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1nn(C(C)(C)C)cc1-c1nn[n-]n1	ZINC000822240238	606622586	/nfs/dbraw/zinc/62/25/86/606622586.db2.gz	YKOOEQQXOWYLSX-UHFFFAOYSA-N	-2	1	395.876	2.581	20	0		GFADML
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1c(Cl)cccc1C(=O)[O-]	ZINC000013269601	654503669	/nfs/dbraw/zinc/50/36/69/654503669.db2.gz	FFHUWSJFOZOOLL-UHFFFAOYSA-N	-2	1	386.769	2.756	20	0		GFADML
COC(=O)c1ccc(Cl)c(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2F)c1	ZINC000026538974	654557440	/nfs/dbraw/zinc/55/74/40/654557440.db2.gz	ZHPOYSLMIZNRCQ-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CN(C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])[C@@H]1CCSC1	ZINC000270230085	655038080	/nfs/dbraw/zinc/03/80/80/655038080.db2.gz	MAIZBIHLNWMPPY-GFCCVEGCSA-N	-2	1	398.531	2.832	20	0		GFADML
O=C([O-])/C=C\C[N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000312001363	655379582	/nfs/dbraw/zinc/37/95/82/655379582.db2.gz	PSTFZQFMRXUCLG-UPHRSURJSA-N	-2	1	389.054	2.675	20	0		GFADML
O=C([O-])[C@@H](CC1CCOCC1)[N-]S(=O)(=O)c1cc(Cl)sc1Cl	ZINC000776600478	656765166	/nfs/dbraw/zinc/76/51/66/656765166.db2.gz	MEYDNZBYJDXKAS-MRVPVSSYSA-N	-2	1	388.294	2.603	20	0		GFADML
COc1ccc(Br)c(S(=O)(=O)[N-][C@@H](C)CCCC(=O)[O-])c1F	ZINC000903838352	663808194	/nfs/dbraw/zinc/80/81/94/663808194.db2.gz	LHLFXRZVZGXEPU-QMMMGPOBSA-N	-2	1	398.250	2.519	20	0		GFADML
O=C([O-])C[C@H]([N-]S(=O)(=O)c1c(F)cc(F)cc1F)c1ccc(F)cc1	ZINC000918726539	664503518	/nfs/dbraw/zinc/50/35/18/664503518.db2.gz	QHMHOWQSYPYVEL-ZDUSSCGKSA-N	-2	1	377.315	2.737	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)CS3)cc1C(=O)[O-]	ZINC000013032305	551108375	/nfs/dbraw/zinc/10/83/75/551108375.db2.gz	JFVVCLAEQCSOHR-UHFFFAOYSA-N	-2	1	378.431	2.538	20	0		GFADML
N#Cc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2Br)s1	ZINC000230327295	553065160	/nfs/dbraw/zinc/06/51/60/553065160.db2.gz	MSPGNVJCAXDNJL-UHFFFAOYSA-N	-2	1	387.236	2.881	20	0		GFADML
C[C@@H](OC(C)(C)C)[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000319354930	563444681	/nfs/dbraw/zinc/44/46/81/563444681.db2.gz	NKIJIVYRBHXURJ-MUWHJKNJSA-N	-2	1	390.310	2.990	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(F)c2)cc1Cl	ZINC000328066033	563461017	/nfs/dbraw/zinc/46/10/17/563461017.db2.gz	QBZGXLGNSAVHBO-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
O=C([O-])CSCC[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000389478631	563522022	/nfs/dbraw/zinc/52/20/22/563522022.db2.gz	RVYPXAPBPCOCAS-UHFFFAOYSA-N	-2	1	378.686	2.743	20	0		GFADML
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000436716920	563678122	/nfs/dbraw/zinc/67/81/22/563678122.db2.gz	AUOSSTXNBDUJIK-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
O=C([O-])c1ccc([O-])c(S(=O)(=O)Nc2ccccc2CC(F)(F)F)c1	ZINC000436993435	563687336	/nfs/dbraw/zinc/68/73/36/563687336.db2.gz	CBRNHNCYTRKPPN-UHFFFAOYSA-N	-2	1	375.324	2.996	20	0		GFADML
CSc1ccc(C)c([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)c1	ZINC000539399614	564219193	/nfs/dbraw/zinc/21/91/93/564219193.db2.gz	WEOJDEMVYKBRDQ-UHFFFAOYSA-N	-3	1	381.431	2.914	20	0		GFADML
CSc1cc2c(cc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1)OCCO2	ZINC000509611764	564305515	/nfs/dbraw/zinc/30/55/15/564305515.db2.gz	UDNVSZPIOHULTM-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc([S@@](C)=O)cc2)cc1C(=O)[O-]	ZINC000479244006	564432831	/nfs/dbraw/zinc/43/28/31/564432831.db2.gz	BMJVQPOJELKKQU-HSZRJFAPSA-N	-2	1	387.866	2.885	20	0		GFADML
CC(C)(C)[C@H](C[N-]S(=O)(=O)c1sccc1Br)CC(=O)[O-]	ZINC000548214665	564537507	/nfs/dbraw/zinc/53/75/07/564537507.db2.gz	QMNJFTGMXFWGMP-QMMMGPOBSA-N	-2	1	384.317	2.926	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)[C@H](C)C(=O)[O-]	ZINC000574534703	564678456	/nfs/dbraw/zinc/67/84/56/564678456.db2.gz	WUHORZPHUHNPMD-WDSKDSINSA-N	-2	1	388.642	2.629	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1csnc1C(=O)[O-])c1ccccc1OC(F)F	ZINC000574753901	564687379	/nfs/dbraw/zinc/68/73/79/564687379.db2.gz	DZAAJSGSIPVXCR-VIFPVBQESA-N	-2	1	392.405	2.872	20	0		GFADML
CC1(C)C[C@H]([N-]S(=O)(=O)c2csnc2C(=O)[O-])c2ccc(F)cc2O1	ZINC000579468794	564747998	/nfs/dbraw/zinc/74/79/98/564747998.db2.gz	KXQSAOFVFPXSBO-JTQLQIEISA-N	-2	1	386.426	2.561	20	0		GFADML
O=C([O-])[C@@H](CCSc1ccccc1)[N-]S(=O)(=O)c1cc(F)ccc1F	ZINC000579656852	564750312	/nfs/dbraw/zinc/75/03/12/564750312.db2.gz	DSXOZKLSGVRNTJ-CQSZACIVSA-N	-2	1	387.429	2.879	20	0		GFADML
COc1ccc(C(=O)[O-])c(NS(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)c1	ZINC000489760400	564751606	/nfs/dbraw/zinc/75/16/06/564751606.db2.gz	BZKUEKIQXPTNNN-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)cc1Cl	ZINC000533167059	564956358	/nfs/dbraw/zinc/95/63/58/564956358.db2.gz	RASXVWOCIWDOKB-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)CCCC(=O)N2	ZINC000591683988	565236356	/nfs/dbraw/zinc/23/63/56/565236356.db2.gz	BNFQJZAGCRWIED-UHFFFAOYSA-N	-2	1	380.447	2.830	20	0		GFADML
COc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccccc1[N-]S(C)(=O)=O	ZINC000642317433	565410287	/nfs/dbraw/zinc/41/02/87/565410287.db2.gz	RYFATKJOJKKOOL-UHFFFAOYSA-N	-2	1	390.870	2.521	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2c(O)cccc2F)c(Br)c1	ZINC000673885167	565851152	/nfs/dbraw/zinc/85/11/52/565851152.db2.gz	SAOKGRUCOHVJGL-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
O=C([O-])[C@@H]1CCCCN1C(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1[O-]	ZINC000821466369	598148990	/nfs/dbraw/zinc/14/89/90/598148990.db2.gz	WGPARNXLDDRVAH-NSHDSACASA-N	-2	1	390.314	2.582	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(C(=O)NC[C@@H](C)C(=O)[O-])c2)c1	ZINC000262473610	599777532	/nfs/dbraw/zinc/77/75/32/599777532.db2.gz	CIDGSJKQMYPNGL-CQSZACIVSA-N	-2	1	390.461	2.555	20	0		GFADML
COC(=O)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C)cc1Cl	ZINC000737717322	599814574	/nfs/dbraw/zinc/81/45/74/599814574.db2.gz	LBVGKYNOIFQVLU-UHFFFAOYSA-N	-2	1	389.838	2.996	20	0		GFADML
O=C([O-])c1sc2ccccc2c1CNC(=O)c1nc2ccccc2c(=O)[n-]1	ZINC000739436918	599881205	/nfs/dbraw/zinc/88/12/05/599881205.db2.gz	WHPKHOGIJJDUAS-UHFFFAOYSA-N	-2	1	379.397	2.766	20	0		GFADML
O=C([O-])CSCc1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)c1	ZINC000739873547	599927116	/nfs/dbraw/zinc/92/71/16/599927116.db2.gz	FJUSNGFHDXPJBW-UHFFFAOYSA-N	-3	1	381.431	2.503	20	0		GFADML
CC(C)[C@H]1CCCC[C@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736396513	599952784	/nfs/dbraw/zinc/95/27/84/599952784.db2.gz	WJJZQTVSTFKZJH-QZTJIDSGSA-N	-2	1	385.464	2.737	20	0		GFADML
CC1=C(C(=O)[O-])[C@@H](c2ccc([O-])c(Cl)c2)NC(=O)N1CCCCC(=O)[O-]	ZINC000736752848	599989185	/nfs/dbraw/zinc/98/91/85/599989185.db2.gz	YRMWRUQETDTBGP-OAHLLOKOSA-N	-3	1	382.800	2.725	20	0		GFADML
O=C([O-])c1cccc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2C(=O)[O-])c1	ZINC000740227701	600058317	/nfs/dbraw/zinc/05/83/17/600058317.db2.gz	QVOGZCKDLKJIBO-UHFFFAOYSA-N	-3	1	389.307	2.903	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])ccc1Cl	ZINC000737664479	600093988	/nfs/dbraw/zinc/09/39/88/600093988.db2.gz	HBIPIABIZTYDCB-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(-c2csnn2)cc1	ZINC000740143584	600098492	/nfs/dbraw/zinc/09/84/92/600098492.db2.gz	GOQYCYSTNMIVLN-UHFFFAOYSA-N	-2	1	379.394	2.843	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CN(C)C(=O)[O-])cc1	ZINC000738291430	600301249	/nfs/dbraw/zinc/30/12/49/600301249.db2.gz	RVJKZVGKFNNMPU-UHFFFAOYSA-N	-3	1	396.396	2.743	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc1NC(C)=O	ZINC000738064122	600638079	/nfs/dbraw/zinc/63/80/79/600638079.db2.gz	SOKJUTJKNLWEJR-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(N3CCCCC3)nc2)cc1C(=O)[O-]	ZINC000738063990	600659453	/nfs/dbraw/zinc/65/94/53/600659453.db2.gz	OBSXMKOXIVTNIR-UHFFFAOYSA-N	-2	1	391.449	2.580	20	0		GFADML
CN(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(N3CCOC3=O)cc2)cc1	ZINC000737335413	600693700	/nfs/dbraw/zinc/69/37/00/600693700.db2.gz	GXENGXVGRIYFKT-UHFFFAOYSA-N	-2	1	391.405	2.558	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ccccc1F)c1nc(-c2cccc(C(=O)[O-])c2)no1	ZINC000827759837	600700097	/nfs/dbraw/zinc/70/00/97/600700097.db2.gz	AQDLTQKEDVPTFE-JTQLQIEISA-N	-2	1	391.380	2.613	20	0		GFADML
CCC(CC)([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000828849213	600792164	/nfs/dbraw/zinc/79/21/64/600792164.db2.gz	SGNRBQLGSRZVBS-UHFFFAOYSA-N	-2	1	386.214	2.649	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)NC(C)(C)CC(=O)[O-])cc1	ZINC000738778679	600790292	/nfs/dbraw/zinc/79/02/92/600790292.db2.gz	SJHPZEAGLDYPES-UHFFFAOYSA-N	-2	1	390.461	2.779	20	0		GFADML
CCn1cnnc1-c1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000506675613	600888755	/nfs/dbraw/zinc/88/87/55/600888755.db2.gz	PKUZYOWPWVDOAY-UHFFFAOYSA-N	-2	1	386.433	2.772	20	0		GFADML
NC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1Cl	ZINC000739179961	600890207	/nfs/dbraw/zinc/89/02/07/600890207.db2.gz	GFZNJOBCUPSKTM-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)N(C)C)c(Cl)c2)ccc1C(=O)[O-]	ZINC000506724640	600890238	/nfs/dbraw/zinc/89/02/38/600890238.db2.gz	BXTAFVINUHJQAK-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
CCC[C@@H]1[C@@H](C)CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829246216	600919207	/nfs/dbraw/zinc/91/92/07/600919207.db2.gz	XLVVEXWLSUJDCV-KBXCAEBGSA-N	-2	1	385.464	2.834	20	0		GFADML
CCC(CC)(NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1)C(=O)[O-]	ZINC000583587316	600925859	/nfs/dbraw/zinc/92/58/59/600925859.db2.gz	HGNZLAJPEULNMN-UHFFFAOYSA-N	-2	1	390.461	2.861	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CC[C@@H]3c3cccc(F)c3)cc2)[n-]1	ZINC000833264982	600934260	/nfs/dbraw/zinc/93/42/60/600934260.db2.gz	OGSZSMAHVUUNPH-GOSISDBHSA-N	-2	1	395.390	2.519	20	0		GFADML
C[C@@H](NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)[C@H](C)c1ccccc1	ZINC000827695266	601184646	/nfs/dbraw/zinc/18/46/46/601184646.db2.gz	PYRHDSIIRKAQIB-LSDHHAIUSA-N	-2	1	393.443	2.715	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3cc(F)ccc3C(=O)[O-])c2)n[nH]1	ZINC000832990907	601205740	/nfs/dbraw/zinc/20/57/40/601205740.db2.gz	LMLMWGGXHLHTCA-UHFFFAOYSA-N	-2	1	390.396	2.727	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3ccc(C)c(C(=O)[O-])c3)ccc2o1	ZINC000831830969	601230189	/nfs/dbraw/zinc/23/01/89/601230189.db2.gz	BWZARHPFYFNMJQ-UHFFFAOYSA-N	-2	1	376.390	2.782	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1C(=O)N(C)C	ZINC000832953006	601250983	/nfs/dbraw/zinc/25/09/83/601250983.db2.gz	UHZWVMHOLILEOT-XFFZJAGNSA-N	-2	1	388.445	2.595	20	0		GFADML
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000013347262	601317773	/nfs/dbraw/zinc/31/77/73/601317773.db2.gz	DPRWURAVVBAXFL-UXBLZVDNSA-N	-2	1	375.402	2.680	20	0		GFADML
CNC(=O)c1cc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)ccc1Cl	ZINC000831005459	601325867	/nfs/dbraw/zinc/32/58/67/601325867.db2.gz	NLKSDDGPONJNIV-WTKPLQERSA-N	-2	1	394.836	2.598	20	0		GFADML
Cc1cc(C(=O)NC(C)C)ccc1[N-]S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000738204497	601326181	/nfs/dbraw/zinc/32/61/81/601326181.db2.gz	KHARVPWXVAMLTQ-UHFFFAOYSA-N	-2	1	394.424	2.771	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)c1	ZINC000831248407	601333076	/nfs/dbraw/zinc/33/30/76/601333076.db2.gz	MGNCJPUPHDHRPB-UHFFFAOYSA-N	-2	1	392.433	2.658	20	0		GFADML
Cc1cc(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2OC(C)C)ccc1C(=O)[O-]	ZINC000507955249	601574908	/nfs/dbraw/zinc/57/49/08/601574908.db2.gz	ZUCFSESLEQRKGZ-UHFFFAOYSA-N	-2	1	393.417	2.979	20	0		GFADML
O=C([O-])CCCc1csc([N-]C(=O)c2noc(-c3cccc(F)c3)n2)n1	ZINC000833229333	601783448	/nfs/dbraw/zinc/78/34/48/601783448.db2.gz	BHPQUVOKXRUZGC-UHFFFAOYSA-N	-2	1	376.369	2.992	20	0		GFADML
Cn1cc([N-]S(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)cc1C(=O)[O-]	ZINC000833053445	601785269	/nfs/dbraw/zinc/78/52/69/601785269.db2.gz	UGJGMUUDTIKBHW-UHFFFAOYSA-N	-2	1	379.438	2.509	20	0		GFADML
O=C([O-])CCOc1ccc(S(=O)(=O)[N-]c2cccc(OCCF)c2)cc1	ZINC000833239373	601856141	/nfs/dbraw/zinc/85/61/41/601856141.db2.gz	HEHJYMHWNFSRDM-UHFFFAOYSA-N	-2	1	383.397	2.689	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1N1CCOC1=O	ZINC000832950705	601863678	/nfs/dbraw/zinc/86/36/78/601863678.db2.gz	VXWPTVUWZCXDFF-UHFFFAOYSA-N	-2	1	394.380	2.590	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)N[C@H]1CCCCCC[C@H]1C(=O)[O-]	ZINC000262992348	602052204	/nfs/dbraw/zinc/05/22/04/602052204.db2.gz	SRZYRYJEXUYHJT-WBVHZDCISA-N	-2	1	398.463	2.635	20	0		GFADML
O=C([O-])N1CCc2cc([N-]S(=O)(=O)c3ccc4c(c3)OCCCO4)ccc21	ZINC000740530506	602246728	/nfs/dbraw/zinc/24/67/28/602246728.db2.gz	ZHAZHCVGSHXSFP-UHFFFAOYSA-N	-2	1	390.417	2.689	20	0		GFADML
CCC(CC)(CNC(=O)[O-])[N-]S(=O)(=O)c1sccc1Br	ZINC000739253058	602564184	/nfs/dbraw/zinc/56/41/84/602564184.db2.gz	AQXAFSMRDINJSA-UHFFFAOYSA-N	-2	1	385.305	2.615	20	0		GFADML
CCCCCNC(=O)C1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000739326844	602849310	/nfs/dbraw/zinc/84/93/10/602849310.db2.gz	MNSIYGBQVNHQGA-UHFFFAOYSA-N	-2	1	377.441	2.641	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(NC(=O)C3CCCCC3)CC2)c([O-])c1	ZINC000740700137	602856208	/nfs/dbraw/zinc/85/62/08/602856208.db2.gz	QPTQFTWKEVWSSM-UHFFFAOYSA-N	-2	1	389.452	2.783	20	0		GFADML
CCN(C[C@@H]1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1)CC(F)(F)F	ZINC000827084121	603702902	/nfs/dbraw/zinc/70/29/02/603702902.db2.gz	QWCFHDMWRITDTO-NSHDSACASA-N	-2	1	389.374	2.828	20	0		GFADML
O=C(CC1C[C@H]2CC[C@@H](C1)N2C(=O)[O-])OCc1cc(=O)oc2cc([O-])ccc12	ZINC000831314162	603809223	/nfs/dbraw/zinc/80/92/23/603809223.db2.gz	RDFFIKTYJDKIJN-QXMXGUDHSA-N	-2	1	387.388	2.853	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@@H]2CCC[C@H]2CNC(=O)[O-])c([O-])c1	ZINC000823827978	603910091	/nfs/dbraw/zinc/91/00/91/603910091.db2.gz	NFCJDMZGTNCPMS-SMDDNHRTSA-N	-2	1	393.440	2.905	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])ccc1F	ZINC000823598073	604013519	/nfs/dbraw/zinc/01/35/19/604013519.db2.gz	PBJAENHMMCJUSS-UHFFFAOYSA-N	-2	1	393.396	2.625	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)OC[C@@H](C)NC(=O)[O-])cc1	ZINC000830587431	604204687	/nfs/dbraw/zinc/20/46/87/604204687.db2.gz	XCTUIUZICPLVHQ-CYBMUJFWSA-N	-2	1	392.433	2.609	20	0		GFADML
Cc1ccc(NC(=O)C2(NC(=O)[O-])CC2)cc1[N-]S(=O)(=O)c1ccccc1	ZINC000830359063	604429663	/nfs/dbraw/zinc/42/96/63/604429663.db2.gz	UVNYGIFANJKRFE-UHFFFAOYSA-N	-2	1	389.433	2.535	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@H](C(=O)[O-])c2ccccn2)c([O-])c1	ZINC000833442950	604717313	/nfs/dbraw/zinc/71/73/13/604717313.db2.gz	NAAPZDVQZWJGOF-HNNXBMFYSA-N	-2	1	387.392	2.690	20	0		GFADML
C[C@@]([N-]S(=O)(=O)c1cc(Br)sc1Cl)(C(=O)[O-])C1CC1	ZINC000827747401	604810338	/nfs/dbraw/zinc/81/03/38/604810338.db2.gz	NOIPSJHBERVYGU-JTQLQIEISA-N	-2	1	388.692	2.696	20	0		GFADML
C[C@H]1CCCN(c2nc([O-])c(CC(=O)Nc3ccsc3C(=O)[O-])s2)C1	ZINC000833615055	604999751	/nfs/dbraw/zinc/99/97/51/604999751.db2.gz	ZSMUAFQCGWAEDH-GXSJLCMTSA-N	-2	1	381.479	2.505	20	0		GFADML
CCN(CC)c1ccc([N-]S(=O)(=O)c2ccc(C3(C(=O)[O-])CC3)cc2)cn1	ZINC000833654683	605135394	/nfs/dbraw/zinc/13/53/94/605135394.db2.gz	ZVDQHGPHAIYRLK-UHFFFAOYSA-N	-2	1	389.477	2.845	20	0		GFADML
O=C([O-])N[C@@H]1CCC[C@@H]2CN(C(=O)c3cc(Br)ccc3[O-])C[C@@H]21	ZINC000834184353	605494763	/nfs/dbraw/zinc/49/47/63/605494763.db2.gz	VWYKIOKVJBHRSQ-JIMOISOXSA-N	-2	1	383.242	2.663	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@@H](CO)c2ccc(C(F)(F)F)cc2)c([O-])c1	ZINC000834254940	605715037	/nfs/dbraw/zinc/71/50/37/605715037.db2.gz	FOAJZGBFXJLCNM-ZDUSSCGKSA-N	-2	1	384.310	2.964	20	0		GFADML
Cc1ccc(Cl)c(S(=O)(=O)[N-]c2ncc(-c3nn[n-]n3)s2)c1Cl	ZINC000822240146	607026601	/nfs/dbraw/zinc/02/66/01/607026601.db2.gz	ULNHTYMYXQXIBY-UHFFFAOYSA-N	-2	1	391.265	2.739	20	0		GFADML
CS(=O)(=O)[N-]c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000036833082	654613874	/nfs/dbraw/zinc/61/38/74/654613874.db2.gz	HHGUVFAMQSWBMQ-UHFFFAOYSA-N	-2	1	378.834	2.651	20	0		GFADML
C[C@H](CCC[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000275049625	655213874	/nfs/dbraw/zinc/21/38/74/655213874.db2.gz	WTWMZSJRLZGRSU-SSDOTTSWSA-N	-2	1	386.214	2.507	20	0		GFADML
Cc1cc(S(=O)(=O)[N-][N-]C(=O)NCCc2cccs2)sc1Cl	ZINC000190256580	655390765	/nfs/dbraw/zinc/39/07/65/655390765.db2.gz	ZVPPLDXGCONTOI-UHFFFAOYSA-N	-2	1	379.916	2.507	20	0		GFADML
O=C(c1s[n-]c(=O)c1Cl)N1CCN(Cc2ccc([O-])c(Cl)c2)CC1	ZINC000870162733	662677053	/nfs/dbraw/zinc/67/70/53/662677053.db2.gz	SKCFMCQEOLXYBV-UHFFFAOYSA-N	-2	1	388.276	2.819	20	0		GFADML
C[C@@H]1CC[C@H](C(=O)[O-])C[C@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000871771913	662733225	/nfs/dbraw/zinc/73/32/25/662733225.db2.gz	TVOIBXTYDDKKRR-KHQFGBGNSA-N	-2	1	382.301	2.678	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)CCS2	ZINC000899949104	663703636	/nfs/dbraw/zinc/70/36/36/663703636.db2.gz	LWJFKKFNVFCLEA-KGXJWFGYSA-N	-2	1	393.889	2.886	20	0		GFADML
O=C([O-])c1ccc(CC[N-]S(=O)(=O)c2sccc2Br)cc1	ZINC000048444275	551156343	/nfs/dbraw/zinc/15/63/43/551156343.db2.gz	UJYYRAGYKFKLMT-UHFFFAOYSA-N	-2	1	390.280	2.730	20	0		GFADML
O=C([O-])[C@@H](Cc1ccc(O)cc1)[N-]S(=O)(=O)c1cc(Cl)sc1Cl	ZINC000320037277	563446313	/nfs/dbraw/zinc/44/63/13/563446313.db2.gz	PUEVKAILXZTMTL-SECBINFHSA-N	-2	1	396.273	2.735	20	0		GFADML
O=C(Nc1cccnc1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436751683	563679005	/nfs/dbraw/zinc/67/90/05/563679005.db2.gz	MSMQELDSQJVYFX-UHFFFAOYSA-N	-2	1	375.431	2.902	20	0		GFADML
COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)[N-]CCCCCC(=O)[O-]	ZINC000417431438	563880181	/nfs/dbraw/zinc/88/01/81/563880181.db2.gz	RFHUVXZDUUKWMO-UHFFFAOYSA-N	-2	1	398.264	2.703	20	0		GFADML
C[C@@H](C[N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl)C(=O)[O-]	ZINC000568156607	564407028	/nfs/dbraw/zinc/40/70/28/564407028.db2.gz	GCRNZRGPBVSOEX-YFKPBYRVSA-N	-2	1	391.070	2.755	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1cccc([S@](C)=O)c1	ZINC000479364645	564437117	/nfs/dbraw/zinc/43/71/17/564437117.db2.gz	OPFLLPFBOVIWIU-QHCPKHFHSA-N	-2	1	387.866	2.885	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc(F)cc1C(=O)[O-]	ZINC000479392777	564439026	/nfs/dbraw/zinc/43/90/26/564439026.db2.gz	PVMKUPYYPZEHIY-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])CCCC[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000548241716	564541330	/nfs/dbraw/zinc/54/13/30/564541330.db2.gz	UGEHWRARQPFPOM-UHFFFAOYSA-N	-2	1	376.681	2.697	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2C)c1	ZINC000548538972	564557524	/nfs/dbraw/zinc/55/75/24/564557524.db2.gz	FXNHXFUPWJRFST-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2C)cc1Cl	ZINC000484563954	564591015	/nfs/dbraw/zinc/59/10/15/564591015.db2.gz	ZOXFPBHLVWGCCU-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1ccc(Cl)c(S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(F)F)c1Cl	ZINC000572984256	564618086	/nfs/dbraw/zinc/61/80/86/564618086.db2.gz	WSXYRIRAKDJCIB-SSDOTTSWSA-N	-2	1	376.208	2.936	20	0		GFADML
O=C([O-])CC[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000582650342	564856518	/nfs/dbraw/zinc/85/65/18/564856518.db2.gz	OKDLTIVAKUNBOJ-UWVGGRQHSA-N	-2	1	380.260	2.744	20	0		GFADML
CC(=O)c1cccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(Cl)c2)c1	ZINC000500328445	564950493	/nfs/dbraw/zinc/95/04/93/564950493.db2.gz	LVJICKGCLLFAGD-UHFFFAOYSA-N	-2	1	383.809	2.807	20	0		GFADML
O=C([O-])c1cc(Br)cc(S(=O)(=O)[N-]c2ccc3c[nH]nc3c2)c1	ZINC000534238576	564982991	/nfs/dbraw/zinc/98/29/91/564982991.db2.gz	JBXOGBKMBFBMMB-UHFFFAOYSA-N	-2	1	396.222	2.824	20	0		GFADML
C[C@H](C(=O)[O-])C1([N-]S(=O)(=O)c2cc(Br)sc2Cl)CC1	ZINC000650427846	565820045	/nfs/dbraw/zinc/82/00/45/565820045.db2.gz	SYCLARQTPNDRDL-RXMQYKEDSA-N	-2	1	388.692	2.696	20	0		GFADML
C[C@H](C[N-]S(=O)(=O)c1cc(Cl)c(Cl)cc1Br)C(=O)[O-]	ZINC000656509044	566129390	/nfs/dbraw/zinc/12/93/90/566129390.db2.gz	JPZHDOSFDKIAHF-RXMQYKEDSA-N	-2	1	391.070	2.755	20	0		GFADML
C[C@@H]1CCc2[n-]n(-c3ccc(S(=O)(=O)[N-]c4nccs4)cc3)c(=O)c21	ZINC000634616975	566161103	/nfs/dbraw/zinc/16/11/03/566161103.db2.gz	CBGKYMGXDOORPG-QMTHXVAHSA-N	-2	1	376.463	2.693	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)NCCCC(=O)[O-])cc2)cc1C	ZINC000262758482	597277210	/nfs/dbraw/zinc/27/72/10/597277210.db2.gz	PPNZRSOSKRJMJL-UHFFFAOYSA-N	-2	1	390.461	2.699	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)NCCCC(=O)[O-])c2)c1	ZINC000262646515	597280784	/nfs/dbraw/zinc/28/07/84/597280784.db2.gz	QZTYMMROZGGIDD-UHFFFAOYSA-N	-2	1	390.461	2.699	20	0		GFADML
O=C([O-])CCC[N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000034936952	597311361	/nfs/dbraw/zinc/31/13/61/597311361.db2.gz	AXBOFEQPNFINMY-UHFFFAOYSA-N	-2	1	391.070	2.899	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccc(-c3n[nH]c(C4CC4)n3)cc2)c1	ZINC000523187416	599768806	/nfs/dbraw/zinc/76/88/06/599768806.db2.gz	BFJMMBNERRZQFB-UHFFFAOYSA-N	-2	1	384.417	2.848	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)NC[C@H](C)C(=O)[O-])cc2)cc1C	ZINC000655561429	599779438	/nfs/dbraw/zinc/77/94/38/599779438.db2.gz	LEPBXXRQFPALLH-AWEZNQCLSA-N	-2	1	390.461	2.555	20	0		GFADML
CCC[C@H]1CCCC[C@@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736973916	599869505	/nfs/dbraw/zinc/86/95/05/599869505.db2.gz	KWGHXACFMISNOT-KSSFIOAISA-N	-2	1	385.464	2.881	20	0		GFADML
O=C([O-])c1ccc(OCCNC(=O)c2cc(Br)ccc2[O-])cc1	ZINC000740166361	599901177	/nfs/dbraw/zinc/90/11/77/599901177.db2.gz	ZPWKMXCDXINFCY-UHFFFAOYSA-N	-2	1	380.194	2.662	20	0		GFADML
CO[C@@H](C)c1cccc(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000737732007	599992242	/nfs/dbraw/zinc/99/22/42/599992242.db2.gz	ALWBHAGCUGGWJK-ZDUSSCGKSA-N	-2	1	395.415	2.752	20	0		GFADML
O=C([O-])c1ccccc1[N-]S(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000541793256	600003051	/nfs/dbraw/zinc/00/30/51/600003051.db2.gz	QIDCQNWUGXPCDN-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1S(=O)(=O)[N-]c1cc(F)c(F)cc1C(=O)[O-]	ZINC000740075901	600069529	/nfs/dbraw/zinc/06/95/29/600069529.db2.gz	RAOKNVCEKMYYHR-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(NC(=O)[C@@H]3C[C@H]3C(=O)[O-])ccc2C)c1	ZINC000262592755	600102688	/nfs/dbraw/zinc/10/26/88/600102688.db2.gz	IEJYVPXGIYOTGZ-HZPDHXFCSA-N	-2	1	388.445	2.763	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2c(F)cccc2-n2cccn2)c(F)cc1F	ZINC000740088590	600237033	/nfs/dbraw/zinc/23/70/33/600237033.db2.gz	ZSJIUOXVRPTUTI-UHFFFAOYSA-N	-2	1	397.334	2.789	20	0		GFADML
Cc1ccc2c(c1)N(C(=O)c1ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc1)CCC2	ZINC000738670562	600271765	/nfs/dbraw/zinc/27/17/65/600271765.db2.gz	NOFYSBSUAVXMMD-UHFFFAOYSA-N	-2	1	391.427	2.694	20	0		GFADML
CC(C)(CCC(=O)[O-])NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000262647796	600418493	/nfs/dbraw/zinc/41/84/93/600418493.db2.gz	RHZSHEKEIKSGMW-UHFFFAOYSA-N	-2	1	390.461	2.861	20	0		GFADML
C[C@H]1CCC[C@H](CCNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736775202	600622252	/nfs/dbraw/zinc/62/22/52/600622252.db2.gz	NBJQDMGKHROLLS-LSDHHAIUSA-N	-2	1	385.464	2.739	20	0		GFADML
CC(C)C(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000481958005	600625468	/nfs/dbraw/zinc/62/54/68/600625468.db2.gz	IPVXPGKKAFCRAZ-UHFFFAOYSA-N	-2	1	376.434	2.709	20	0		GFADML
CCOC(=O)/C=C\c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000737138173	600626133	/nfs/dbraw/zinc/62/61/33/600626133.db2.gz	ZYZGHZPVYWOJOJ-GHXNOFRVSA-N	-2	1	389.429	2.691	20	0		GFADML
O=C([O-])c1cc(Cl)cc([N-]S(=O)(=O)c2ccc(N3CCCC3=O)cc2)c1	ZINC000740072815	600638456	/nfs/dbraw/zinc/63/84/56/600638456.db2.gz	SCJOZNQGAFOHNL-UHFFFAOYSA-N	-2	1	394.836	2.966	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2c[nH]c(C(=O)[O-])c2)cc1OC1CCCC1	ZINC000751268668	600674212	/nfs/dbraw/zinc/67/42/12/600674212.db2.gz	FVJCMTMUNIJQFI-UHFFFAOYSA-N	-2	1	380.422	2.844	20	0		GFADML
Cc1cccc(S(=O)(=O)[N-]c2cccc(N3CCOC3=O)c2C)c1C(=O)[O-]	ZINC000832972953	600691655	/nfs/dbraw/zinc/69/16/55/600691655.db2.gz	RDFJNYSNEPSQMG-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1N1CCOC1=O	ZINC000763287180	600867848	/nfs/dbraw/zinc/86/78/48/600867848.db2.gz	OIAPGQFAENYQQE-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc3c(c2)CCC(=O)N3)c1	ZINC000740305984	600889913	/nfs/dbraw/zinc/88/99/13/600889913.db2.gz	PLDCDMQADFSHRZ-UHFFFAOYSA-N	-2	1	380.809	2.724	20	0		GFADML
O=C([O-])CCOc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000739738879	600894762	/nfs/dbraw/zinc/89/47/62/600894762.db2.gz	KHRLKUKEWPIMLT-UHFFFAOYSA-N	-3	1	399.808	2.693	20	0		GFADML
Cc1ccc(NC(=O)c2ccc(S(=O)(=O)[N-]C(C)(C)C)o2)cc1C(=O)[O-]	ZINC000486338859	601063484	/nfs/dbraw/zinc/06/34/84/601063484.db2.gz	WVWAIPSJQGYUAD-UHFFFAOYSA-N	-2	1	380.422	2.615	20	0		GFADML
Cc1oc(S(=O)(=O)[N-]Cc2ccc(F)cc2C(F)(F)F)cc1C(=O)[O-]	ZINC000833027025	601217137	/nfs/dbraw/zinc/21/71/37/601217137.db2.gz	NLOZDIXSIZJWPO-UHFFFAOYSA-N	-2	1	381.303	2.923	20	0		GFADML
CNC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000029324789	601319985	/nfs/dbraw/zinc/31/99/85/601319985.db2.gz	JQUQGBVQLHBVLD-UHFFFAOYSA-N	-2	1	377.422	2.554	20	0		GFADML
COC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000057125520	601325614	/nfs/dbraw/zinc/32/56/14/601325614.db2.gz	GIGPTIKJJMXFLP-UHFFFAOYSA-N	-2	1	382.369	2.527	20	0		GFADML
O=C([O-])[C@H]1CCCCN1C(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000262591434	601743302	/nfs/dbraw/zinc/74/33/02/601743302.db2.gz	UXYKSEXMRRABGC-QGZVFWFLSA-N	-2	1	388.445	2.567	20	0		GFADML
CNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000326940468	601827214	/nfs/dbraw/zinc/82/72/14/601827214.db2.gz	XOGHSAWIKIQXCS-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])ccc1Cl	ZINC000757471940	601827756	/nfs/dbraw/zinc/82/77/56/601827756.db2.gz	JZLXJIKXAAFHLY-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(F)c(F)cc2C(=O)[O-])ccc1Cl	ZINC000728854504	601828423	/nfs/dbraw/zinc/82/84/23/601828423.db2.gz	MWYUOXBWAOGLTJ-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
CC1(C)Cc2cc(S(=O)(=O)[N-]c3ccc4[nH]nc(C(=O)[O-])c4c3)ccc2O1	ZINC000828082864	601830604	/nfs/dbraw/zinc/83/06/04/601830604.db2.gz	WJOUMXGASXIHGK-UHFFFAOYSA-N	-2	1	387.417	2.775	20	0		GFADML
CCCc1ccc(-c2cc([N-]S(=O)(=O)c3csnc3C(=O)[O-])[nH]n2)cc1	ZINC000829566427	601831087	/nfs/dbraw/zinc/83/10/87/601831087.db2.gz	MASJOFFXUOPNMQ-UHFFFAOYSA-N	-2	1	392.462	2.985	20	0		GFADML
Cc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)c1C(=O)[O-]	ZINC000735027282	601841745	/nfs/dbraw/zinc/84/17/45/601841745.db2.gz	IAJVMEGUFPQJIY-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(N2CCCC2=O)c(F)c1	ZINC000833295451	601862217	/nfs/dbraw/zinc/86/22/17/601862217.db2.gz	XJTUFNINBGQLSU-UHFFFAOYSA-N	-2	1	396.371	2.591	20	0		GFADML
O=C([O-])NC1(C[N-]S(=O)(=O)c2sccc2Br)CCCCC1	ZINC000740549072	601987752	/nfs/dbraw/zinc/98/77/52/601987752.db2.gz	VSHRMIUYUJMRPR-UHFFFAOYSA-N	-2	1	397.316	2.759	20	0		GFADML
Cc1nc(C)n(-c2ccccc2[N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)n1	ZINC000507952423	601989304	/nfs/dbraw/zinc/98/93/04/601989304.db2.gz	QWVNVPBIHJDYBM-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
CC(C)(C)c1nnc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)s1	ZINC000826528319	602121279	/nfs/dbraw/zinc/12/12/79/602121279.db2.gz	VVTIGCVCNPBSIL-UHFFFAOYSA-N	-2	1	389.886	2.666	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(CCc3ccccc3)n[nH]2)ccc1F	ZINC000833304291	602307307	/nfs/dbraw/zinc/30/73/07/602307307.db2.gz	XLKYCCNFXTVHCN-UHFFFAOYSA-N	-2	1	389.408	2.833	20	0		GFADML
COC(=O)/C=C\c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)cc1	ZINC000754758656	602321085	/nfs/dbraw/zinc/32/10/85/602321085.db2.gz	NFIWFCIFNYYOMT-WTKPLQERSA-N	-2	1	379.365	2.511	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])cc2)ccc1F	ZINC000737154112	602644779	/nfs/dbraw/zinc/64/47/79/602644779.db2.gz	KBZYIIPUDZJAKT-UHFFFAOYSA-N	-2	1	382.369	2.893	20	0		GFADML
COc1ccc(NC(=O)[O-])c([N-]S(=O)(=O)c2ccc3c(c2)C[C@@H](C)O3)c1	ZINC000739924656	602652703	/nfs/dbraw/zinc/65/27/03/602652703.db2.gz	UBNYTXPZEBNZEN-SNVBAGLBSA-N	-2	1	378.406	2.909	20	0		GFADML
CCc1cc2c(COC(=O)C3(NC(=O)[O-])CCCC3)cc(=O)oc2cc1[O-]	ZINC000739544400	602653062	/nfs/dbraw/zinc/65/30/62/602653062.db2.gz	ZUHZATMTZPMNDU-UHFFFAOYSA-N	-2	1	375.377	2.685	20	0		GFADML
Cc1c(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])c(=O)n(-c2ccccc2)n1C	ZINC000740047070	602840007	/nfs/dbraw/zinc/84/00/07/602840007.db2.gz	CMXRTYGMTCGDPI-UHFFFAOYSA-N	-2	1	382.376	2.532	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCCCC(=O)N2Cc3ccccc3C2)c([O-])c1	ZINC000740698120	602863317	/nfs/dbraw/zinc/86/33/17/602863317.db2.gz	KZRKUWMMOHCTAF-UHFFFAOYSA-N	-2	1	383.404	2.535	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)c([O-])c1	ZINC000740698728	602863716	/nfs/dbraw/zinc/86/37/16/602863716.db2.gz	PMNHZNPFTHXAAA-AWEZNQCLSA-N	-2	1	384.310	2.964	20	0		GFADML
O=C([O-])NCCOc1cccc([N-]S(=O)(=O)c2ccc3ncccc3c2)c1	ZINC000832671560	603399411	/nfs/dbraw/zinc/39/94/11/603399411.db2.gz	DNGSCWGKTNBTIW-UHFFFAOYSA-N	-2	1	387.417	2.682	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])cc1C(F)(F)F	ZINC000833321936	604399931	/nfs/dbraw/zinc/39/99/31/604399931.db2.gz	RLBRCKVUEJVNDH-UHFFFAOYSA-N	-3	1	389.307	2.903	20	0		GFADML
Cc1ccc(NC(=O)C2(NC(=O)[O-])CC2)cc1S(=O)(=O)[N-]c1ccccc1	ZINC000830357197	604429850	/nfs/dbraw/zinc/42/98/50/604429850.db2.gz	FGHQMXXUBCRYDU-UHFFFAOYSA-N	-2	1	389.433	2.535	20	0		GFADML
CC(C)(C)NC(=O)c1cccc([N-]S(=O)(=O)c2ccc(F)cc2C(=O)[O-])c1	ZINC000833430778	604744468	/nfs/dbraw/zinc/74/44/68/604744468.db2.gz	HVNPUKAMRRWLMJ-UHFFFAOYSA-N	-2	1	394.424	2.853	20	0		GFADML
CCC(=O)c1cccc([N-]S(=O)(=O)c2cc(C(=O)OC)ccc2C(=O)[O-])c1	ZINC000828580210	604806654	/nfs/dbraw/zinc/80/66/54/604806654.db2.gz	CMSVLOTXUILTDI-UHFFFAOYSA-N	-2	1	391.401	2.565	20	0		GFADML
Cc1ccc(-c2[nH]nc([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])c2C)o1	ZINC000832907152	604809119	/nfs/dbraw/zinc/80/91/19/604809119.db2.gz	JGRWEXVJDPKTQN-UHFFFAOYSA-N	-2	1	379.369	2.925	20	0		GFADML
CCc1oc(C(=O)[O-])cc1S(=O)(=O)[N-][C@H](Cc1ccccc1)C(F)(F)F	ZINC000833684070	605441820	/nfs/dbraw/zinc/44/18/20/605441820.db2.gz	ZAAIRAQYTDQNIX-CQSZACIVSA-N	-2	1	391.367	2.992	20	0		GFADML
O=C([O-])N(CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1)C1CC1	ZINC000834004031	605979353	/nfs/dbraw/zinc/97/93/53/605979353.db2.gz	XJQZOJSWBZWVDA-UHFFFAOYSA-N	-2	1	389.433	2.568	20	0		GFADML
CCC(CC)(C[N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000818431848	660226043	/nfs/dbraw/zinc/22/60/43/660226043.db2.gz	ZJFLTJKTGSEXOH-UHFFFAOYSA-N	-2	1	399.694	2.667	20	0		GFADML
O=C(N[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1)c1ccc(Cl)cc1[O-]	ZINC000055665005	654780090	/nfs/dbraw/zinc/78/00/90/654780090.db2.gz	IPLDTXGQPNRUNJ-UHFFFAOYSA-N	-2	1	395.651	2.976	20	0		GFADML
Cc1cc(C(=O)[O-])ccc1S(=O)(=O)[N-]c1ccc(Br)nc1C	ZINC000320768745	655382424	/nfs/dbraw/zinc/38/24/24/655382424.db2.gz	YCLYUMBVPSTJFC-UHFFFAOYSA-N	-2	1	385.239	2.960	20	0		GFADML
COc1cc(S(=O)(=O)[N-][N-]C(=O)c2c(Cl)cccc2Cl)ccc1F	ZINC000190766048	655394669	/nfs/dbraw/zinc/39/46/69/655394669.db2.gz	GAJSNUROGQIRJG-UHFFFAOYSA-N	-2	1	393.223	2.764	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])c(F)cc1Br)C(F)F	ZINC000840890317	661199447	/nfs/dbraw/zinc/19/94/47/661199447.db2.gz	KNXMQVCZYVIDNX-MRVPVSSYSA-N	-2	1	390.177	2.608	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(C)c(Cl)c(C(=O)[O-])c2)c1	ZINC000759094641	655947388	/nfs/dbraw/zinc/94/73/88/655947388.db2.gz	JVDBJINISJVTIN-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccccc2C[S@](C)=O)cc(C(=O)[O-])c1F	ZINC000762453802	656042716	/nfs/dbraw/zinc/04/27/16/656042716.db2.gz	PKUMLFDZSYHBMH-DEOSSOPVSA-N	-2	1	385.438	2.512	20	0		GFADML
O=C([O-])C[C@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccsc1	ZINC000776445730	656742700	/nfs/dbraw/zinc/74/27/00/656742700.db2.gz	QKJHBTMHTXFTHP-VIFPVBQESA-N	-2	1	381.262	2.944	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccccc1	ZINC000776571653	656760759	/nfs/dbraw/zinc/76/07/59/656760759.db2.gz	TVQOMMYXDSBMCK-NSHDSACASA-N	-2	1	389.260	2.925	20	0		GFADML
O=C(Nc1nc(Cl)ccc1[O-])c1cccc([N-]S(=O)(=O)C(F)(F)F)c1	ZINC000790048153	657920717	/nfs/dbraw/zinc/92/07/17/657920717.db2.gz	QZQAGQWYLJFNQN-UHFFFAOYSA-N	-2	1	395.746	2.954	20	0		GFADML
COc1cc(Cl)c(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)cc1C(=O)[O-]	ZINC000790382523	657965264	/nfs/dbraw/zinc/96/52/64/657965264.db2.gz	UYPBFXZMMDLCIA-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
C[C@]1(C[N-]S(=O)(=O)c2sc(C(=O)[O-])cc2Br)CC1(F)F	ZINC000871984686	662749200	/nfs/dbraw/zinc/74/92/00/662749200.db2.gz	ZSCAEIOEFWJEEY-SECBINFHSA-N	-2	1	390.227	2.532	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@H]([N-]S(=O)(=O)c1sccc1Cl)CCS2	ZINC000899949455	663703786	/nfs/dbraw/zinc/70/37/86/663703786.db2.gz	OLWYKNYXIIOONT-XQVHRTOBSA-N	-2	1	381.928	2.809	20	0		GFADML
Cc1cc(Cl)ccc1CN1CCC[C@H]([N-]C(=O)C(F)(F)F)[C@H]1C(=O)[O-]	ZINC000903707178	663804626	/nfs/dbraw/zinc/80/46/26/663804626.db2.gz	SHZWTZVDDLGGJX-STQMWFEESA-N	-2	1	378.778	2.745	20	0		GFADML
O=C([O-])C[C@H](CC[N-]S(=O)(=O)c1ccc(Cl)cc1F)C(F)(F)F	ZINC000285313376	563514594	/nfs/dbraw/zinc/51/45/94/563514594.db2.gz	ZFGBXHYYMGJPFL-ZETCQYMHSA-N	-2	1	377.743	2.801	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)ccc1Cl	ZINC000432645882	563590411	/nfs/dbraw/zinc/59/04/11/563590411.db2.gz	QGCKPMDHVVCYTQ-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
Cc1ccc(Br)cc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1[O-]	ZINC000433501217	563614391	/nfs/dbraw/zinc/61/43/91/563614391.db2.gz	ZGJGOEOFVNTCCM-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
CCS(=O)(=O)c1ccc([O-])c(NC(=O)c2cc(Cl)c([O-])c(OC)c2)c1	ZINC000436818815	563680068	/nfs/dbraw/zinc/68/00/68/563680068.db2.gz	WLKMZFNOGGMIMU-UHFFFAOYSA-N	-2	1	385.825	2.806	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(-c3nc[nH]n3)cc2)cc1Cl	ZINC000438757434	563709863	/nfs/dbraw/zinc/70/98/63/563709863.db2.gz	XIVXBTBKVOSHKY-UHFFFAOYSA-N	-2	1	378.797	2.624	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)ccc1OCCO	ZINC000541125805	564267179	/nfs/dbraw/zinc/26/71/79/564267179.db2.gz	HOKBMVPLAXTTTK-UHFFFAOYSA-N	-2	1	385.825	2.519	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2cccc([S@](C)=O)c2)cc1C(=O)[O-]	ZINC000479260556	564433691	/nfs/dbraw/zinc/43/36/91/564433691.db2.gz	GFNBMHSEWZUKEW-QHCPKHFHSA-N	-2	1	387.866	2.885	20	0		GFADML
O=C([O-])[C@@H](CCSc1ccccc1)[N-]S(=O)(=O)c1cccc(F)c1F	ZINC000516220890	564496850	/nfs/dbraw/zinc/49/68/50/564496850.db2.gz	FGYXAYDHJGEIKM-CYBMUJFWSA-N	-2	1	387.429	2.879	20	0		GFADML
O=C([O-])c1cc(F)cc([N-]S(=O)(=O)c2ccc(C(F)(F)F)nc2)c1F	ZINC000547932516	564523015	/nfs/dbraw/zinc/52/30/15/564523015.db2.gz	HTGYLGUTUZSTCV-UHFFFAOYSA-N	-2	1	382.266	2.878	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2cnn(CC(F)(F)F)c2)c(Cl)c1	ZINC000548216176	564537662	/nfs/dbraw/zinc/53/76/62/564537662.db2.gz	UPQSWWHVPOSXII-UHFFFAOYSA-N	-2	1	383.735	2.598	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2csc(C(=O)[O-])c2)cc1Cl	ZINC000518089978	564546081	/nfs/dbraw/zinc/54/60/81/564546081.db2.gz	RECREYUYLVPBNP-UHFFFAOYSA-N	-2	1	391.854	2.926	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cccc(F)c1F)Cc1ccccc1Cl	ZINC000548530815	564556043	/nfs/dbraw/zinc/55/60/43/564556043.db2.gz	UPQFLOZFMBUMMF-LLVKDONJSA-N	-2	1	389.807	2.840	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2cc3c(c(C(=O)[O-])c2)OCCO3)cc1Cl	ZINC000484956897	564602939	/nfs/dbraw/zinc/60/29/39/564602939.db2.gz	AUYGJKVWGXXBEW-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
C[C@H](C[N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl)C(=O)[O-]	ZINC000573149949	564625127	/nfs/dbraw/zinc/62/51/27/564625127.db2.gz	PTPHTTJRXGIILD-RXMQYKEDSA-N	-2	1	391.070	2.755	20	0		GFADML
CC(C)(C)CC[C@](C)([N-]S(=O)(=O)c1ccc(Br)o1)C(=O)[O-]	ZINC000556416248	564825527	/nfs/dbraw/zinc/82/55/27/564825527.db2.gz	KMTQSOKHKSTJFP-ZDUSSCGKSA-N	-2	1	382.276	2.990	20	0		GFADML
CC(C)c1nc(C2([N-]S(=O)(=O)c3ccsc3C(=O)[O-])CCCC2)no1	ZINC000645990297	565581346	/nfs/dbraw/zinc/58/13/46/565581346.db2.gz	UJVAJMWRICSAJE-UHFFFAOYSA-N	-2	1	385.467	2.701	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]CC2(CC(=O)[O-])CCCCC2)c(F)c1	ZINC000681562063	566112457	/nfs/dbraw/zinc/11/24/57/566112457.db2.gz	VPFUDFBLQVJNPQ-UHFFFAOYSA-N	-2	1	377.409	2.677	20	0		GFADML
COc1cc(C(=O)[O-])cc([N-]S(=O)(=O)C[C@H](C)CC(F)(F)F)c1OC	ZINC000656510364	566129869	/nfs/dbraw/zinc/12/98/69/566129869.db2.gz	DZAVLCKINHBSEL-MRVPVSSYSA-N	-2	1	385.360	2.732	20	0		GFADML
Cc1cccc2c1CC[C@@H]2NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000738747971	599774945	/nfs/dbraw/zinc/77/49/45/599774945.db2.gz	MXEAMSRXFTUILO-IBGZPJMESA-N	-2	1	391.427	2.518	20	0		GFADML
CC[C@H](C)[C@@H](C)N(C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CC1	ZINC000736870245	599775014	/nfs/dbraw/zinc/77/50/14/599775014.db2.gz	KAXQKBQTAKKMIN-UONOGXRCSA-N	-2	1	385.464	2.832	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)c1C	ZINC000738345186	599853064	/nfs/dbraw/zinc/85/30/64/599853064.db2.gz	IDPOEXRRONKQLK-UHFFFAOYSA-N	-3	1	377.418	2.820	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(CN2CCCC2=O)cc1	ZINC000268650408	599905949	/nfs/dbraw/zinc/90/59/49/599905949.db2.gz	UROBUQBVXBFMLA-UHFFFAOYSA-N	-2	1	388.445	2.616	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(C(=O)N(C)C)c(Cl)c1	ZINC000477408075	599907188	/nfs/dbraw/zinc/90/71/88/599907188.db2.gz	UMEMEVZRFAQYDG-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1	ZINC000477405340	599908203	/nfs/dbraw/zinc/90/82/03/599908203.db2.gz	NXGHNCAVVXKLES-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)[N-]c2cccc(NC(=O)[O-])c2)c1	ZINC000738477821	600057874	/nfs/dbraw/zinc/05/78/74/600057874.db2.gz	HARRIPMYKNQIDK-UHFFFAOYSA-N	-2	1	398.462	2.598	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(OC[C@H]2CCCO2)cc1	ZINC000740143108	600096396	/nfs/dbraw/zinc/09/63/96/600096396.db2.gz	CEIQHZCWGBTLKP-OAHLLOKOSA-N	-2	1	395.408	2.883	20	0		GFADML
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)cc1	ZINC000737155848	600100284	/nfs/dbraw/zinc/10/02/84/600100284.db2.gz	XGCIMCFCNMSIJC-UHFFFAOYSA-N	-2	1	382.369	2.893	20	0		GFADML
O=C([O-])NCc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)cc1	ZINC000740001936	600303323	/nfs/dbraw/zinc/30/33/23/600303323.db2.gz	UDGSWMUMMUEEBX-UHFFFAOYSA-N	-2	1	384.797	2.607	20	0		GFADML
C[C@H]1CCCC[C@H]1CCNC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736777775	600424318	/nfs/dbraw/zinc/42/43/18/600424318.db2.gz	DGLXZDFJEGKOMU-GJZGRUSLSA-N	-2	1	385.464	2.739	20	0		GFADML
CC(C)(C)[C@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1)C(=O)[O-]	ZINC000675985334	600553771	/nfs/dbraw/zinc/55/37/71/600553771.db2.gz	OUSACGGAFNHTHL-MRXNPFEDSA-N	-2	1	390.461	2.717	20	0		GFADML
Cc1ccnc(-c2cccc([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)c2)n1	ZINC000481956305	600611814	/nfs/dbraw/zinc/61/18/14/600611814.db2.gz	BMLCIRVXPXFDKK-UHFFFAOYSA-N	-2	1	383.429	2.880	20	0		GFADML
CSc1cc2c(cc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)[O-])c1)OCCO2	ZINC000509612761	600814904	/nfs/dbraw/zinc/81/49/04/600814904.db2.gz	DRSDQPKVACDPOD-UHFFFAOYSA-N	-2	1	395.458	2.987	20	0		GFADML
CC(=O)c1cnn(-c2ccc(-c3nc4cc(C(=O)[O-])ccc4c(=O)[n-]3)cc2)c1C	ZINC000825964806	600845553	/nfs/dbraw/zinc/84/55/53/600845553.db2.gz	URWWXXHNECWCOT-UHFFFAOYSA-N	-2	1	388.383	2.985	20	0		GFADML
CC(C)NC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000736477601	600890647	/nfs/dbraw/zinc/89/06/47/600890647.db2.gz	IFHIOJPSYCDBQY-UHFFFAOYSA-N	-2	1	396.852	2.977	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCC4(C3)CCCCC4)cc2)[n-]1	ZINC000739873536	601067125	/nfs/dbraw/zinc/06/71/25/601067125.db2.gz	DSIZVZHPVRBKGH-UHFFFAOYSA-N	-2	1	383.448	2.589	20	0		GFADML
O=C([O-])c1ccsc1N1CC[C@@H](NC(=O)c2ccc3ccccc3c2[O-])C1=O	ZINC000833341871	601068449	/nfs/dbraw/zinc/06/84/49/601068449.db2.gz	RXJYHAXKKDOESO-OAHLLOKOSA-N	-2	1	396.424	2.840	20	0		GFADML
CCOc1ccc(F)c(C(=O)[O-])c1NS(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000477394435	601116707	/nfs/dbraw/zinc/11/67/07/601116707.db2.gz	RYXNGOGEVFJKEA-UHFFFAOYSA-N	-2	1	397.380	2.730	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3cccc(C)c3C(=O)[O-])c2)n[nH]1	ZINC000832991124	601205868	/nfs/dbraw/zinc/20/58/68/601205868.db2.gz	QODDJRXADNLOTQ-UHFFFAOYSA-N	-2	1	386.433	2.896	20	0		GFADML
O=C([O-])c1ccc([O-])c(S(=O)(=O)Nc2cc3ccccc3cc2C(=O)[O-])c1	ZINC000748671212	601249779	/nfs/dbraw/zinc/24/97/79/601249779.db2.gz	FCNHNNQCMJPZHV-UHFFFAOYSA-N	-3	1	387.369	2.743	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1C	ZINC000831434819	601330340	/nfs/dbraw/zinc/33/03/40/601330340.db2.gz	FMIGVZROACGCKA-YHYXMXQVSA-N	-2	1	375.402	2.680	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cccc(C[S@](C)=O)c2C)c1C	ZINC000265246240	601330820	/nfs/dbraw/zinc/33/08/20/601330820.db2.gz	IEECCIPYBRFZIC-VWLOTQADSA-N	-2	1	395.502	2.989	20	0		GFADML
O=C([O-])CC1(NC(=O)c2ccc(S(=O)(=O)[N-]c3ccccc3)cc2)CCC1	ZINC000262486624	601434518	/nfs/dbraw/zinc/43/45/18/601434518.db2.gz	LIAFXUPWSJYTAY-UHFFFAOYSA-N	-2	1	388.445	2.615	20	0		GFADML
O=C([O-])CC1(NC(=O)c2ccc([N-]S(=O)(=O)c3ccccc3)cc2)CCC1	ZINC000262523345	601438998	/nfs/dbraw/zinc/43/89/98/601438998.db2.gz	RDIYNQVSHTZYHC-UHFFFAOYSA-N	-2	1	388.445	2.615	20	0		GFADML
CC[C@@H](NC(=O)c1cc(S(=O)(=O)[N-]c2ccc(F)cc2)ccc1C)C(=O)[O-]	ZINC000485869691	601750347	/nfs/dbraw/zinc/75/03/47/601750347.db2.gz	MEBGIJKWZMMYFQ-MRXNPFEDSA-N	-2	1	394.424	2.528	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3ccc(C(=O)[O-])cc3)ccc2o1	ZINC000831795606	601795324	/nfs/dbraw/zinc/79/53/24/601795324.db2.gz	APHUPBCIADFTKC-UHFFFAOYSA-N	-2	1	376.390	2.516	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(F)c(C(=O)[O-])c(F)c2)ccc1Cl	ZINC000833303973	601830719	/nfs/dbraw/zinc/83/07/19/601830719.db2.gz	BWLVEYHENBNXJE-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
CC(=O)Nc1ccc(C)c([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1	ZINC000751145409	601835572	/nfs/dbraw/zinc/83/55/72/601835572.db2.gz	FZTSWJMXOHJFDV-UHFFFAOYSA-N	-2	1	384.360	2.731	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(OCCF)c2)cc(F)c1F	ZINC000759679926	601855643	/nfs/dbraw/zinc/85/56/43/601855643.db2.gz	WUTPJGJFEMLGHT-UHFFFAOYSA-N	-2	1	375.324	2.812	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])ccc1Cl	ZINC000831327755	601857940	/nfs/dbraw/zinc/85/79/40/601857940.db2.gz	OAKMSFKVHBRLIB-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])c(C)c1	ZINC000831779532	601859863	/nfs/dbraw/zinc/85/98/63/601859863.db2.gz	OBNXPGJAOPCJIK-UHFFFAOYSA-N	-2	1	383.397	2.658	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@@H]2CCCCCC[C@@H]2C(=O)[O-])c(=O)[n-]1	ZINC000832795297	601914808	/nfs/dbraw/zinc/91/48/08/601914808.db2.gz	YCHBXVFOHJAJQA-UONOGXRCSA-N	-2	1	381.498	2.685	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)CCN2C(=O)[O-]	ZINC000740046635	602244202	/nfs/dbraw/zinc/24/42/02/602244202.db2.gz	RFTGIIDLGPKWFE-UHFFFAOYSA-N	-3	1	394.380	2.674	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccc2c(c1)CCN2C(=O)[O-]	ZINC000739517721	602253439	/nfs/dbraw/zinc/25/34/39/602253439.db2.gz	FWPFMUPPNDZKKI-UHFFFAOYSA-N	-2	1	389.433	2.741	20	0		GFADML
CCN(Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)OC)cc2)c1)C(=O)[O-]	ZINC000739445691	602654199	/nfs/dbraw/zinc/65/41/99/602654199.db2.gz	FFMGZXOKQUFBJI-UHFFFAOYSA-N	-2	1	392.433	2.774	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)c(O)c1	ZINC000740698237	602845988	/nfs/dbraw/zinc/84/59/88/602845988.db2.gz	ACCJNZHQUKMSSB-UHFFFAOYSA-N	-2	1	384.388	2.923	20	0		GFADML
CC(C)(C)OC(=O)NC1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000738715079	602850076	/nfs/dbraw/zinc/85/00/76/602850076.db2.gz	FWWPYXQDDLWSHQ-UHFFFAOYSA-N	-2	1	379.413	2.611	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCCN(C(=O)c3ccsc3)CC2)c([O-])c1	ZINC000740699964	602853992	/nfs/dbraw/zinc/85/39/92/602853992.db2.gz	NYVBKBKFAUAMCS-UHFFFAOYSA-N	-2	1	389.433	2.532	20	0		GFADML
COc1cccc(N2CCC[C@@H](NC(=O)c3ccc(NC(=O)[O-])cc3[O-])C2)c1	ZINC000739954210	602867285	/nfs/dbraw/zinc/86/72/85/602867285.db2.gz	WWURMKCTHHYEFK-CQSZACIVSA-N	-2	1	385.420	2.890	20	0		GFADML
CSc1nc(C)c(CCC(=O)O[C@@H]2CCCC[C@H]2CNC(=O)[O-])c(=O)[n-]1	ZINC000829777741	603466155	/nfs/dbraw/zinc/46/61/55/603466155.db2.gz	MCFQXQCKWQBELT-WCQYABFASA-N	-2	1	383.470	2.515	20	0		GFADML
COc1ccccc1[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])o1)c1ccco1	ZINC000832597414	604363779	/nfs/dbraw/zinc/36/37/79/604363779.db2.gz	XCGGFCRXNQNJIH-MRXNPFEDSA-N	-2	1	377.374	2.647	20	0		GFADML
Cc1cc([C@H](C)OC(=O)c2ccc(S(=O)(=O)[N-]C(C)(C)C)o2)oc1C(=O)[O-]	ZINC000832874667	604565108	/nfs/dbraw/zinc/56/51/08/604565108.db2.gz	KKRVQLRLIMCJSU-JTQLQIEISA-N	-2	1	399.421	2.874	20	0		GFADML
CC(C)Oc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)[O-])c(F)c1	ZINC000489556487	604766463	/nfs/dbraw/zinc/76/64/63/604766463.db2.gz	KLSPWYGZKPDGTP-UHFFFAOYSA-N	-2	1	397.380	2.810	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(C3CCCC3)n[nH]2)c(OC)c1C(=O)[O-]	ZINC000833734780	604862133	/nfs/dbraw/zinc/86/21/33/604862133.db2.gz	WCVXZFKWNZYNPZ-UHFFFAOYSA-N	-2	1	395.437	2.584	20	0		GFADML
CCC[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)cc2)cc1)C(=O)[O-]	ZINC000540785520	605022922	/nfs/dbraw/zinc/02/29/22/605022922.db2.gz	KBJRJTKVWOFMKO-INIZCTEOSA-N	-2	1	394.424	2.610	20	0		GFADML
CCC(CC)(CNC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)C(=O)[O-]	ZINC000644180967	605098182	/nfs/dbraw/zinc/09/81/82/605098182.db2.gz	WKBLNIRFTGVNCK-UHFFFAOYSA-N	-2	1	376.453	2.888	20	0		GFADML
CC(=O)N(C)c1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2C(=O)[O-])c1	ZINC000833389318	605167763	/nfs/dbraw/zinc/16/77/63/605167763.db2.gz	KKKWPXDTYYNINI-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)c([O-])c1	ZINC000834259302	605643280	/nfs/dbraw/zinc/64/32/80/605643280.db2.gz	YHHJYTVUOSNOSC-MRXNPFEDSA-N	-2	1	383.404	2.576	20	0		GFADML
O=C([O-])[C@@H](CSCc1cccc2ccccc21)[N-]S(=O)(=O)C(F)F	ZINC000817419644	660194927	/nfs/dbraw/zinc/19/49/27/660194927.db2.gz	FQOUCEXZXWARTH-CYBMUJFWSA-N	-2	1	375.418	2.668	20	0		GFADML
C[C@H](CCC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br	ZINC000274952453	655208718	/nfs/dbraw/zinc/20/87/18/655208718.db2.gz	GLRPVPAJPXJGOM-ZCFIWIBFSA-N	-2	1	388.642	2.773	20	0		GFADML
O=C([O-])[C@@H](CC(F)F)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F	ZINC000275200286	655222470	/nfs/dbraw/zinc/22/24/70/655222470.db2.gz	GQIHQPMBRNXRGY-SSDOTTSWSA-N	-2	1	381.706	2.746	20	0		GFADML
CC(C)(C)c1csc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)n1	ZINC000185005672	655361688	/nfs/dbraw/zinc/36/16/88/655361688.db2.gz	DFPZLIVSUTYBKQ-UHFFFAOYSA-N	-2	1	390.433	2.896	20	0		GFADML
COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)[N-][C@H](CC(C)C)C(=O)[O-]	ZINC000263565310	655452629	/nfs/dbraw/zinc/45/26/29/655452629.db2.gz	VOBDSJJHAFVEMI-LLVKDONJSA-N	-2	1	398.264	2.558	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])c1Cl	ZINC000753773755	655858342	/nfs/dbraw/zinc/85/83/42/655858342.db2.gz	CEEOBNPPIDQVKC-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
COc1cc(F)c([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)cc1F	ZINC000756936526	655907026	/nfs/dbraw/zinc/90/70/26/655907026.db2.gz	LEAAAWWGWMZSAB-UHFFFAOYSA-N	-2	1	379.287	2.751	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])cc(C(=O)[O-])c1Cl	ZINC000759093509	655947400	/nfs/dbraw/zinc/94/74/00/655947400.db2.gz	CIQGFBUDXAUWPM-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])[C@H](CCc1ccccc1)[N-]S(=O)(=O)c1c(Cl)ccnc1Cl	ZINC000776453438	656742979	/nfs/dbraw/zinc/74/29/79/656742979.db2.gz	LMJROYRNXLYRPT-LBPRGKRZSA-N	-2	1	389.260	2.753	20	0		GFADML
Cc1cccc([C@@H]([N-]S(=O)(=O)c2c(Cl)ccnc2Cl)C(=O)[O-])c1	ZINC000776500951	656748757	/nfs/dbraw/zinc/74/87/57/656748757.db2.gz	RMESWAWADRUZNS-LLVKDONJSA-N	-2	1	375.233	2.801	20	0		GFADML
Cc1cc(S(=O)(=O)[N-][C@@H](C[C@H]2CCCO2)C(F)(F)F)sc1C(=O)[O-]	ZINC000871979726	662748538	/nfs/dbraw/zinc/74/85/38/662748538.db2.gz	SCRANXCFRMFUJM-BDAKNGLRSA-N	-2	1	387.401	2.533	20	0		GFADML
O=C([O-])CCCCCC[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000917845618	664490962	/nfs/dbraw/zinc/49/09/62/664490962.db2.gz	AJBQHAKGMPNJMB-UHFFFAOYSA-N	-2	1	399.694	2.811	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]CCOC(F)(F)F)c(Cl)cc1Cl	ZINC000398178964	677412290	/nfs/dbraw/zinc/41/22/90/677412290.db2.gz	QPSBDIJZSYFJNB-UHFFFAOYSA-N	-2	1	382.143	2.506	20	0		GFADML
C[C@H](C[N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl)C(=O)[O-]	ZINC000054333836	551168783	/nfs/dbraw/zinc/16/87/83/551168783.db2.gz	WCNWZMIVHQPUCW-RXMQYKEDSA-N	-2	1	391.070	2.755	20	0		GFADML
CC(C)C[C@H](C[N-]S(=O)(=O)c1sccc1Br)CC(=O)[O-]	ZINC000115921868	551210428	/nfs/dbraw/zinc/21/04/28/551210428.db2.gz	LHHKHNZWTIZQIC-VIFPVBQESA-N	-2	1	384.317	2.926	20	0		GFADML
CCCc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2[N-]S(C)(=O)=O)cc1	ZINC000179765613	552202602	/nfs/dbraw/zinc/20/26/02/552202602.db2.gz	UKSOQYUYACFUDW-UHFFFAOYSA-N	-2	1	386.470	2.951	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F)c1nc(C)cs1	ZINC000185007357	552350974	/nfs/dbraw/zinc/35/09/74/552350974.db2.gz	FDTALOYKWDEUOF-SNVBAGLBSA-N	-2	1	376.406	2.858	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])n(C)c2)cc(C)c1Br	ZINC000191800703	552538248	/nfs/dbraw/zinc/53/82/48/552538248.db2.gz	WOKGGRDLFNGMMU-UHFFFAOYSA-N	-2	1	387.255	2.903	20	0		GFADML
O=C(NC[C@@H]1CCSC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000279250294	563289111	/nfs/dbraw/zinc/28/91/11/563289111.db2.gz	RUBKABFLPGYOSA-NSHDSACASA-N	-2	1	398.531	2.737	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Br)cc1	ZINC000314423967	563439169	/nfs/dbraw/zinc/43/91/69/563439169.db2.gz	XZSUHOJDKSFJJE-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1C	ZINC000327742245	563459606	/nfs/dbraw/zinc/45/96/06/563459606.db2.gz	KLSQIMUCHQZNEF-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)cc1	ZINC000327843196	563459974	/nfs/dbraw/zinc/45/99/74/563459974.db2.gz	PUMGUFYUWWSGFN-UHFFFAOYSA-N	-2	1	385.825	2.864	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]CC[C@@H](CC(=O)[O-])C(F)(F)F)c(F)cc1F	ZINC000285013261	563498642	/nfs/dbraw/zinc/49/86/42/563498642.db2.gz	HNSOVVKZKRJQEF-QMMMGPOBSA-N	-2	1	375.315	2.595	20	0		GFADML
Cc1nc(=NC(=O)c2cnc3c(Cl)cc(Br)cc3c2[O-])s[n-]1	ZINC000430644999	563546444	/nfs/dbraw/zinc/54/64/44/563546444.db2.gz	BIGXIUCNRMFYCH-UHFFFAOYSA-N	-2	1	399.657	2.778	20	0		GFADML
O=C(NCc1cscn1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436536151	563673747	/nfs/dbraw/zinc/67/37/47/563673747.db2.gz	OYNDLIBGDNEBFQ-UHFFFAOYSA-N	-2	1	395.487	2.641	20	0		GFADML
CN(C)C(=O)c1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])cc1	ZINC000442358818	563771863	/nfs/dbraw/zinc/77/18/63/563771863.db2.gz	ZHYQXTHDGTUIPZ-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
C[C@H](Sc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1)C(=O)[O-]	ZINC000507567150	564232243	/nfs/dbraw/zinc/23/22/43/564232243.db2.gz	PCZGRQZGRNCIQS-JTQLQIEISA-N	-3	1	381.431	2.751	20	0		GFADML
Cc1cccc([C@@H]([N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000547548439	564493425	/nfs/dbraw/zinc/49/34/25/564493425.db2.gz	JJKMAUCCFYUGCU-CYBMUJFWSA-N	-2	1	384.797	2.661	20	0		GFADML
COc1cc(C(=O)[O-])c([N-]S(=O)(=O)CCC(C)(C)C)c(OC)c1OC	ZINC000481442861	564512394	/nfs/dbraw/zinc/51/23/94/564512394.db2.gz	WTEFTFAHVAWUJG-UHFFFAOYSA-N	-2	1	375.443	2.589	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)ccc1[O-]	ZINC000481564212	564516789	/nfs/dbraw/zinc/51/67/89/564516789.db2.gz	BYEXLSKEIGPAPJ-UHFFFAOYSA-N	-2	1	384.797	2.503	20	0		GFADML
C[C@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl	ZINC000484581333	564591249	/nfs/dbraw/zinc/59/12/49/564591249.db2.gz	DWBNESRPNZJACK-RXMQYKEDSA-N	-2	1	391.070	2.897	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2ccc3c(c2)COC3)ccc1Br	ZINC000484946827	564603154	/nfs/dbraw/zinc/60/31/54/564603154.db2.gz	OAXIDSMLFFQTSP-UHFFFAOYSA-N	-2	1	398.234	2.978	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)Nc2cc(C(=O)[O-])cc(C(F)(F)F)c2)cs1	ZINC000520768071	564613122	/nfs/dbraw/zinc/61/31/22/564613122.db2.gz	UDGCEIBCGVOYGY-UHFFFAOYSA-N	-2	1	395.336	2.964	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc([C@@H]2CCC(=O)N2)c1	ZINC000573085415	564622293	/nfs/dbraw/zinc/62/22/93/564622293.db2.gz	FOPYFWDLXSJKCO-LBPRGKRZSA-N	-2	1	380.447	2.507	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)[N-]CC[C@@H](CC(=O)[O-])C(F)(F)F)cc1F	ZINC000573113885	564623464	/nfs/dbraw/zinc/62/34/64/564623464.db2.gz	UGUMBIQYYNRUIP-QMMMGPOBSA-N	-2	1	375.315	2.595	20	0		GFADML
O=C([O-])c1cc(N2CCSCC2)ccc1[N-]S(=O)(=O)c1ccsc1	ZINC000551996093	564671642	/nfs/dbraw/zinc/67/16/42/564671642.db2.gz	LIJGJFKLTKXQKO-UHFFFAOYSA-N	-2	1	384.504	2.800	20	0		GFADML
COC(=O)Cc1cccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000581916529	564822860	/nfs/dbraw/zinc/82/28/60/564822860.db2.gz	CWPGLTDNFKUWQR-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
CCOC(=O)c1c[n-]c(NC(=O)c2cc(Br)cc(Cl)c2[O-])n1	ZINC000585682101	565105646	/nfs/dbraw/zinc/10/56/46/565105646.db2.gz	GOJXMHSZQMKRTK-UHFFFAOYSA-N	-2	1	388.605	2.960	20	0		GFADML
C[C@H]1CCc2[n-]n(-c3ccc(S(=O)(=O)[N-]c4nccs4)cc3)c(=O)c21	ZINC000634616974	566160236	/nfs/dbraw/zinc/16/02/36/566160236.db2.gz	CBGKYMGXDOORPG-IINYFYTJSA-N	-2	1	376.463	2.693	20	0		GFADML
O=C([O-])Cc1ccccc1NS(=O)(=O)c1cc(C(=O)[O-])c(F)cc1Cl	ZINC000819626278	597316591	/nfs/dbraw/zinc/31/65/91/597316591.db2.gz	ONJVSQVEVYNJLZ-UHFFFAOYSA-N	-2	1	387.772	2.605	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N(C)[C@H](C)C(=O)[O-])cc2)cc1C	ZINC000263337310	597460657	/nfs/dbraw/zinc/46/06/57/597460657.db2.gz	WQMCNMHKMYKQDR-CQSZACIVSA-N	-2	1	390.461	2.649	20	0		GFADML
O=C([O-])c1ccccc1[N-]S(=O)(=O)c1cccc(NC(=O)C(F)(F)F)c1	ZINC000740239037	599728735	/nfs/dbraw/zinc/72/87/35/599728735.db2.gz	FUYDTQGCOVAEEB-UHFFFAOYSA-N	-2	1	388.323	2.686	20	0		GFADML
CC(C)COC[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1F)c1ccco1	ZINC000736445186	599731478	/nfs/dbraw/zinc/73/14/78/599731478.db2.gz	CNROYMGXEWGBFU-AWEZNQCLSA-N	-2	1	385.413	2.809	20	0		GFADML
CC[C@](C)(NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)c1ccccc1	ZINC000736861403	599762094	/nfs/dbraw/zinc/76/20/94/599762094.db2.gz	KYKDOEGSLCKORI-QFIPXVFZSA-N	-2	1	393.443	2.848	20	0		GFADML
CC(C)[C@@H](NC(=O)[O-])C(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000736382807	599843531	/nfs/dbraw/zinc/84/35/31/599843531.db2.gz	SGKMDIMYSHACIB-MRXNPFEDSA-N	-2	1	391.449	2.718	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cccc(C(=O)N(C)C(C)(C)C(=O)[O-])c2)c1	ZINC000262378404	599847875	/nfs/dbraw/zinc/84/78/75/599847875.db2.gz	CFKFDVZOQSJWBR-UHFFFAOYSA-N	-2	1	390.461	2.731	20	0		GFADML
COC(=O)c1ccc(C(=O)[O-])c(S(=O)(=O)[N-]c2ccc(SC)cc2)c1	ZINC000737681522	599878887	/nfs/dbraw/zinc/87/88/87/599878887.db2.gz	JQRCNDOQDJJOFW-UHFFFAOYSA-N	-2	1	381.431	2.694	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc(-c3n[nH]c(C4CC4)n3)c2)cc1	ZINC000588634510	599926631	/nfs/dbraw/zinc/92/66/31/599926631.db2.gz	YIMXOGNJWLPHBR-UHFFFAOYSA-N	-2	1	384.417	2.848	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(-c3nnc4n3CCCC4)cc2)cc1	ZINC000066814445	599974333	/nfs/dbraw/zinc/97/43/33/599974333.db2.gz	BEFXLBDIZQSDOH-UHFFFAOYSA-N	-2	1	398.444	2.780	20	0		GFADML
Cn1ccc2c1cccc2NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000739039615	599993322	/nfs/dbraw/zinc/99/33/22/599993322.db2.gz	PQNAFSBJBZKZDX-UHFFFAOYSA-N	-2	1	390.399	2.537	20	0		GFADML
Cc1cccc(C[C@H](C[N-]S(=O)(=O)c2ccc(F)c(F)c2F)C(=O)[O-])c1	ZINC000547898075	600096380	/nfs/dbraw/zinc/09/63/80/600096380.db2.gz	IPIUKLJNTLBHGS-GFCCVEGCSA-N	-2	1	387.379	2.634	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(F)c(NC(=O)[O-])c1	ZINC000737257872	600099992	/nfs/dbraw/zinc/09/99/92/600099992.db2.gz	QUQSOEFMZANIHE-UHFFFAOYSA-N	-3	1	382.369	2.977	20	0		GFADML
COCc1cccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2N2CCCC2)c1	ZINC000737835216	600103702	/nfs/dbraw/zinc/10/37/02/600103702.db2.gz	WFLCFRNKVLLSJJ-UHFFFAOYSA-N	-2	1	390.461	2.932	20	0		GFADML
C[C@H](CN(C)C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)c1ccccc1	ZINC000736576132	600121419	/nfs/dbraw/zinc/12/14/19/600121419.db2.gz	VQUZDPNZVJZASK-OAHLLOKOSA-N	-2	1	393.443	2.668	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)N(C)C(C)(C)C(=O)[O-])cc2)cc1	ZINC000262497082	600171810	/nfs/dbraw/zinc/17/18/10/600171810.db2.gz	XNGNQYMQQDOOBK-UHFFFAOYSA-N	-2	1	390.461	2.731	20	0		GFADML
O=C([O-])NCc1ccc([N-]S(=O)(=O)c2ccc(F)c3ncccc23)cc1	ZINC000740001799	600303608	/nfs/dbraw/zinc/30/36/08/600303608.db2.gz	QWRXTYKVXLZZOO-UHFFFAOYSA-N	-2	1	375.381	2.942	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccc(CN(C)C(=O)[O-])cc1	ZINC000737226380	600305256	/nfs/dbraw/zinc/30/52/56/600305256.db2.gz	JWHHOPDYYDHMDK-UHFFFAOYSA-N	-2	1	391.449	2.810	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)c1	ZINC000736064359	600545033	/nfs/dbraw/zinc/54/50/33/600545033.db2.gz	HYWYKERAHNDLKX-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)Nc3ccc4[nH]ccc4c3)cc2)[n-]1	ZINC000739877073	600568135	/nfs/dbraw/zinc/56/81/35/600568135.db2.gz	JNHBSAXVAMZDJB-UHFFFAOYSA-N	-2	1	376.372	2.526	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@H](C(=O)[O-])c1ccccc1F	ZINC000830136675	600653296	/nfs/dbraw/zinc/65/32/96/600653296.db2.gz	DYBMQOSFEAFZTF-HNNXBMFYSA-N	-2	1	381.381	2.570	20	0		GFADML
O=C([O-])Cn1cc(S(=O)(=O)[N-]c2ccc(-c3ccccc3)cc2F)cn1	ZINC000833274951	600674878	/nfs/dbraw/zinc/67/48/78/600674878.db2.gz	OCQCOUIAFKWHSR-UHFFFAOYSA-N	-2	1	375.381	2.575	20	0		GFADML
Cc1ccc(N2CCOC2=O)cc1[N-]S(=O)(=O)c1cc(F)ccc1C(=O)[O-]	ZINC000832940754	600691780	/nfs/dbraw/zinc/69/17/80/600691780.db2.gz	WPWMBBTZHXFJEF-UHFFFAOYSA-N	-2	1	394.380	2.590	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)N(C)C)c(C)c1	ZINC000607102984	600694140	/nfs/dbraw/zinc/69/41/40/600694140.db2.gz	OFESNAHRLJOVKF-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
O=C([O-])CCCOc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2F)cc1	ZINC000833228015	600817075	/nfs/dbraw/zinc/81/70/75/600817075.db2.gz	XUCVAOBQQWMEBS-UHFFFAOYSA-N	-2	1	397.380	2.568	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1N1CCOC1=O	ZINC000832953005	600868384	/nfs/dbraw/zinc/86/83/84/600868384.db2.gz	UGWZKNSJYCNBEV-UHFFFAOYSA-N	-2	1	394.380	2.590	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1C	ZINC000737711959	600888236	/nfs/dbraw/zinc/88/82/36/600888236.db2.gz	BZNJFYBPZYVEFQ-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737123487	600891744	/nfs/dbraw/zinc/89/17/44/600891744.db2.gz	CKJSTLDPNBFQGZ-UHFFFAOYSA-N	-2	1	397.840	2.980	20	0		GFADML
C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000828161768	601140020	/nfs/dbraw/zinc/14/00/20/601140020.db2.gz	PKMWYAGFJRSNSU-CXAGYDPISA-N	-2	1	385.464	2.737	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCN(c2ccc(C(=O)[O-])cc2)C[C@H]1C	ZINC000832994329	601280152	/nfs/dbraw/zinc/28/01/52/601280152.db2.gz	SKDPZVZTOIDNFR-CYBMUJFWSA-N	-2	1	398.463	2.663	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cccc(N3CCCC3=O)c2)c1C	ZINC000013032219	601318360	/nfs/dbraw/zinc/31/83/60/601318360.db2.gz	IAKZSYKWZOGBHP-UHFFFAOYSA-N	-2	1	388.445	2.929	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2C)c1	ZINC000476402424	601321584	/nfs/dbraw/zinc/32/15/84/601321584.db2.gz	SKUHGXVJYYDGSI-UHFFFAOYSA-N	-2	1	377.418	2.897	20	0		GFADML
Cc1nc(-c2ccc([N-]S(=O)(=O)c3ccc(C=CC(=O)[O-])cc3)cc2)n[nH]1	ZINC000832989856	601329283	/nfs/dbraw/zinc/32/92/83/601329283.db2.gz	IEYHWFMXEGVKCM-NYYWCZLTSA-N	-2	1	384.417	2.679	20	0		GFADML
C/C(=C\COC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1)C(=O)[O-]	ZINC000825780945	601410345	/nfs/dbraw/zinc/41/03/45/601410345.db2.gz	LVMFNVRCPIBILI-JLHYYAGUSA-N	-2	1	375.402	2.675	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cc2ccccc2o1)Cc1cccc(F)c1	ZINC000833164052	601563373	/nfs/dbraw/zinc/56/33/73/601563373.db2.gz	NKOROKWICIMAIZ-CQSZACIVSA-N	-2	1	377.393	2.794	20	0		GFADML
CCCc1ccc(-c2cc([N-]S(=O)(=O)c3cc(C(=O)[O-])n(C)c3)[nH]n2)cc1	ZINC000444422513	601603888	/nfs/dbraw/zinc/60/38/88/601603888.db2.gz	MVWUZIHFVCSFDB-UHFFFAOYSA-N	-2	1	388.449	2.867	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(-c3ccccc3C)n[nH]2)cc1C(=O)[O-]	ZINC000485879974	601604155	/nfs/dbraw/zinc/60/41/55/601604155.db2.gz	GYDZZOHAYVIXKJ-UHFFFAOYSA-N	-2	1	387.417	2.893	20	0		GFADML
CCCC[C@H](NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CCC1	ZINC000829295839	601720315	/nfs/dbraw/zinc/72/03/15/601720315.db2.gz	LHKZTOXPQDGIHL-SFHVURJKSA-N	-2	1	385.464	2.881	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)OCc1ccc(C(=O)[O-])c(F)c1	ZINC000830136659	601725840	/nfs/dbraw/zinc/72/58/40/601725840.db2.gz	DDSKJZNXILJFDF-UHFFFAOYSA-N	-2	1	381.381	2.643	20	0		GFADML
Cn1cnnc1-c1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000032592662	601827423	/nfs/dbraw/zinc/82/74/23/601827423.db2.gz	FLZOFCNUWHFGPR-UHFFFAOYSA-N	-2	1	392.824	2.635	20	0		GFADML
C[S@@](=O)Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000734416224	601829368	/nfs/dbraw/zinc/82/93/68/601829368.db2.gz	QAQHNXKOOCNQSM-HSZRJFAPSA-N	-2	1	387.866	2.718	20	0		GFADML
CCC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1	ZINC000751145140	601835516	/nfs/dbraw/zinc/83/55/16/601835516.db2.gz	BVAUOGLJDMMZAR-UHFFFAOYSA-N	-2	1	384.360	2.812	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)cc(C(=O)[O-])c1F	ZINC000832904637	601984776	/nfs/dbraw/zinc/98/47/76/601984776.db2.gz	WJQMECZWPJDWNR-UHFFFAOYSA-N	-3	1	386.332	2.862	20	0		GFADML
Cc1csc([C@H](C)[N-]S(=O)(=O)c2cc(C(=O)[O-])oc2Br)n1	ZINC000096742964	602152198	/nfs/dbraw/zinc/15/21/98/602152198.db2.gz	MQGUTQSLZYZMDM-LURJTMIESA-N	-2	1	395.256	2.545	20	0		GFADML
CCC[C@](C)(NC(=O)[O-])C(=O)OCc1cc(=O)oc2cc([O-])c(CC)cc12	ZINC000739299691	602285309	/nfs/dbraw/zinc/28/53/09/602285309.db2.gz	XANXBJXJIPCDDZ-IBGZPJMESA-N	-2	1	377.393	2.931	20	0		GFADML
O=C([O-])c1cc2c(c(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(F)c3)c1)CCCC2	ZINC000533627205	602323264	/nfs/dbraw/zinc/32/32/64/602323264.db2.gz	CQOSUWOFWQTDSA-UHFFFAOYSA-N	-3	1	393.392	2.902	20	0		GFADML
CC(C)C[C@H](NC(=O)[O-])c1noc([C@H](C)[N-]S(=O)(=O)c2cccs2)n1	ZINC000738817945	602408419	/nfs/dbraw/zinc/40/84/19/602408419.db2.gz	VTDNQHUCAIUSOK-UWVGGRQHSA-N	-2	1	388.471	2.525	20	0		GFADML
O=C([O-])Nc1ccccc1[N-]S(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000740717110	602652591	/nfs/dbraw/zinc/65/25/91/602652591.db2.gz	REYXKFSOGWWPOA-UHFFFAOYSA-N	-2	1	375.406	2.704	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)c([O-])c1	ZINC000740697025	602863551	/nfs/dbraw/zinc/86/35/51/602863551.db2.gz	FECHTYJVWCOFIZ-CYBMUJFWSA-N	-2	1	389.795	2.671	20	0		GFADML
Cc1ccc(NC(=O)C[C@@H](C)NC(=O)[O-])cc1[N-]S(=O)(=O)c1ccccc1	ZINC000830363019	603332517	/nfs/dbraw/zinc/33/25/17/603332517.db2.gz	COHZBOZAFKHBFT-CYBMUJFWSA-N	-2	1	391.449	2.781	20	0		GFADML
O=C([O-])C[C@@H]1CCCN1c1ccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2)cn1	ZINC000833212337	604469783	/nfs/dbraw/zinc/46/97/83/604469783.db2.gz	ZQPOPFRXSLLICZ-LBPRGKRZSA-N	-2	1	397.403	2.604	20	0		GFADML
O=C([O-])c1sccc1NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)[O-])c1	ZINC000833306344	604633791	/nfs/dbraw/zinc/63/37/91/604633791.db2.gz	UVGNVTUDZGPJRS-UHFFFAOYSA-N	-2	1	379.774	2.738	20	0		GFADML
CC(C)(C)OC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])nc2)c(F)c1	ZINC000833444051	604690567	/nfs/dbraw/zinc/69/05/67/604690567.db2.gz	KCVHBATXMAQFRU-UHFFFAOYSA-N	-2	1	396.396	2.675	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)c(OC)c1C(=O)[O-]	ZINC000833734499	604862025	/nfs/dbraw/zinc/86/20/25/604862025.db2.gz	ILQOQGNDKRRFKO-UHFFFAOYSA-N	-2	1	391.323	2.620	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(C3(C(=O)[O-])CC3)cc2)ccc1F	ZINC000833398979	605123971	/nfs/dbraw/zinc/12/39/71/605123971.db2.gz	ZNBNXMPNVQHNHL-UHFFFAOYSA-N	-2	1	392.408	2.701	20	0		GFADML
CC(=O)N1CCCc2cc([N-]S(=O)(=O)c3cc(F)cc(C(=O)[O-])c3)ccc21	ZINC000485249841	605163446	/nfs/dbraw/zinc/16/34/46/605163446.db2.gz	CEIZCXYFTUIXNI-UHFFFAOYSA-N	-2	1	392.408	2.624	20	0		GFADML
O=C([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc2c(c1)NC(=O)CS2	ZINC000833785893	605169605	/nfs/dbraw/zinc/16/96/05/605169605.db2.gz	DFGKQSUSQXIXBQ-UHFFFAOYSA-N	-2	1	398.849	2.883	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2-n2cc(C)cn2)cc1	ZINC000833734459	605189968	/nfs/dbraw/zinc/18/99/68/605189968.db2.gz	GCVUDTDUAIJMGI-UHFFFAOYSA-N	-2	1	387.417	2.688	20	0		GFADML
O=C([O-])N[C@@H]1CCC[C@H]2CN(C(=O)c3cc(Br)ccc3[O-])C[C@H]21	ZINC000834184375	605495287	/nfs/dbraw/zinc/49/52/87/605495287.db2.gz	VWYKIOKVJBHRSQ-ZWKOPEQDSA-N	-2	1	383.242	2.663	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)c(C)c1	ZINC000050533148	654720451	/nfs/dbraw/zinc/72/04/51/654720451.db2.gz	QRUCBPHVTQAWBR-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C(N[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1)c1ccc(Cl)cc1[O-]	ZINC000055665126	654780164	/nfs/dbraw/zinc/78/01/64/654780164.db2.gz	XYTWRTKIAZNPPL-UHFFFAOYSA-N	-2	1	394.758	2.688	20	0		GFADML
CN(C)C(=O)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1Cl	ZINC000057125273	654801467	/nfs/dbraw/zinc/80/14/67/654801467.db2.gz	GLTYCDUNIDDXMM-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
C[C@]1(C(=O)[O-])CCCC[C@@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000135572810	655020973	/nfs/dbraw/zinc/02/09/73/655020973.db2.gz	XGVXLWSJTXNLEG-CABZTGNLSA-N	-2	1	382.301	2.822	20	0		GFADML
O=C([O-])C[C@H](CC[N-]S(=O)(=O)c1ccc(Cl)nc1Cl)C(F)(F)F	ZINC000285001485	655343003	/nfs/dbraw/zinc/34/30/03/655343003.db2.gz	GYQBAJHJRMDGJE-LURJTMIESA-N	-2	1	395.186	2.710	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)cc(OC)c1	ZINC000767735945	656217628	/nfs/dbraw/zinc/21/76/28/656217628.db2.gz	NOAXFSDNFYXXRH-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1cc(F)ccc1F	ZINC000776503305	656748915	/nfs/dbraw/zinc/74/89/15/656748915.db2.gz	AMZHEZIKWABFDS-SNVBAGLBSA-N	-2	1	397.186	2.771	20	0		GFADML
CCc1nc(C[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)ccc1C(=O)[O-]	ZINC000776636590	656772877	/nfs/dbraw/zinc/77/28/77/656772877.db2.gz	FHDUZMOMBPRZOT-UHFFFAOYSA-N	-2	1	390.248	2.523	20	0		GFADML
COC1(C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CCC(C)CC1	ZINC000794917947	658635946	/nfs/dbraw/zinc/63/59/46/658635946.db2.gz	NLYIDPGATMNRCS-UHFFFAOYSA-N	-2	1	377.409	2.537	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1Cl	ZINC000392218231	563525990	/nfs/dbraw/zinc/52/59/90/563525990.db2.gz	WVLDETQTBFDGGK-UHFFFAOYSA-N	-2	1	382.825	2.726	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])CCS1	ZINC000332309512	563592391	/nfs/dbraw/zinc/59/23/91/563592391.db2.gz	SJSJSIKULVEVTE-NSHDSACASA-N	-2	1	398.531	2.832	20	0		GFADML
COc1ccc(NC(=O)c2cc(F)c([O-])c(Cl)c2)cc1[N-]S(C)(=O)=O	ZINC000436917285	563685341	/nfs/dbraw/zinc/68/53/41/563685341.db2.gz	XCPUWFNTWKORRG-UHFFFAOYSA-N	-2	1	388.804	2.817	20	0		GFADML
CN(C)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])cc1	ZINC000442354277	563771753	/nfs/dbraw/zinc/77/17/53/563771753.db2.gz	SHEBCUGIORBIHZ-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
CNC(=O)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2C)c1	ZINC000476292569	564333229	/nfs/dbraw/zinc/33/32/29/564333229.db2.gz	YQGUIATVDYBBAP-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(F)c1C(=O)[O-]	ZINC000476421211	564338889	/nfs/dbraw/zinc/33/88/89/564338889.db2.gz	YKIJSLUHVVZNTC-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])c1c(F)cccc1[N-]S(=O)(=O)c1ccc(OCC(F)F)cc1	ZINC000543165108	564341077	/nfs/dbraw/zinc/34/10/77/564341077.db2.gz	PCFOOISHFJXMAT-UHFFFAOYSA-N	-2	1	375.324	2.969	20	0		GFADML
CCc1ccc([C@H](COC)[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)o1	ZINC000546958823	564475246	/nfs/dbraw/zinc/47/52/46/564475246.db2.gz	YHVXUNNWXAMHMC-ZDUSSCGKSA-N	-2	1	387.841	2.860	20	0		GFADML
CCC[C@@H](C)CS(=O)(=O)[N-]c1c(C(=O)[O-])cc(OC)c(OC)c1OC	ZINC000547546869	564492793	/nfs/dbraw/zinc/49/27/93/564492793.db2.gz	BWXHJSPIBHCVQT-SNVBAGLBSA-N	-2	1	375.443	2.589	20	0		GFADML
CC[C@H](C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)CC(=O)[O-]	ZINC000547611240	564502265	/nfs/dbraw/zinc/50/22/65/564502265.db2.gz	PWSKLLKHDXNPAM-ZETCQYMHSA-N	-2	1	386.214	2.507	20	0		GFADML
C[C@@H](CCC[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000548544698	564558282	/nfs/dbraw/zinc/55/82/82/564558282.db2.gz	IYVIYFZNNCVLPD-LURJTMIESA-N	-2	1	390.708	2.943	20	0		GFADML
C[C@H]1CC[C@](C[N-]S(=O)(=O)c2ccc(Br)o2)(CC(=O)[O-])C1	ZINC000548547317	564558440	/nfs/dbraw/zinc/55/84/40/564558440.db2.gz	CISIXVHYHQCYHS-TVQRCGJNSA-N	-2	1	380.260	2.602	20	0		GFADML
O=C([O-])[C@@H](CC1CCCCC1)[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000548983464	564582928	/nfs/dbraw/zinc/58/29/28/564582928.db2.gz	AWUIZSIMFFSLOY-SNVBAGLBSA-N	-2	1	380.260	2.744	20	0		GFADML
Cc1c(C[S@](C)=O)cccc1[N-]S(=O)(=O)c1cc(F)cc(C(=O)[O-])c1	ZINC000485301337	564611876	/nfs/dbraw/zinc/61/18/76/564611876.db2.gz	UWPXUQUINDIGMP-DEOSSOPVSA-N	-2	1	385.438	2.512	20	0		GFADML
CC(C)(C)c1nnc(C[N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])s1	ZINC000575746060	564702737	/nfs/dbraw/zinc/70/27/37/564702737.db2.gz	VCMAGTXWZDEMLU-UHFFFAOYSA-N	-2	1	389.886	2.666	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)Nc1cc(F)c(F)cc1C(=O)[O-]	ZINC000591682192	565236093	/nfs/dbraw/zinc/23/60/93/565236093.db2.gz	DOIXDGYCUVANOJ-UHFFFAOYSA-N	-2	1	377.346	2.532	20	0		GFADML
COC(=O)CCS(=O)(=O)Nc1cc(Br)cc(C(C)(C)C)c1O	ZINC000594465635	565390218	/nfs/dbraw/zinc/39/02/18/565390218.db2.gz	FXSJXBLKXFJLQQ-UHFFFAOYSA-N	-2	1	394.287	2.757	20	0		GFADML
CC12CC(C1)CN2C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000621210935	565409786	/nfs/dbraw/zinc/40/97/86/565409786.db2.gz	MMJJWESIKBSEAU-UHFFFAOYSA-N	-2	1	378.475	2.879	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]C[C@@H](c2ccccc2)C(F)(F)F)oc1C(=O)[O-]	ZINC000663424603	565420186	/nfs/dbraw/zinc/42/01/86/565420186.db2.gz	MWHKNZWTUONOCS-NSHDSACASA-N	-2	1	377.340	2.911	20	0		GFADML
O=C([O-])[C@@H](CC1CCCCC1)[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000646043101	565584653	/nfs/dbraw/zinc/58/46/53/565584653.db2.gz	DTFAGFVVRWSJOB-GFCCVEGCSA-N	-2	1	380.388	2.802	20	0		GFADML
CC1([C@@H]([N-]S(=O)(=O)c2ncccc2C(F)(F)F)C(=O)[O-])CCCCC1	ZINC000650418182	565818959	/nfs/dbraw/zinc/81/89/59/565818959.db2.gz	CRRNCWXXPWGLTF-NSHDSACASA-N	-2	1	380.388	2.802	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]C[C@H](CCC(=O)[O-])C(F)(F)F)c(F)c1F	ZINC000629305482	565840408	/nfs/dbraw/zinc/84/04/08/565840408.db2.gz	UHNUFQVPQOBULB-QMMMGPOBSA-N	-2	1	375.315	2.595	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(O[C@H]2CCOC2)cc1	ZINC000606827052	565971118	/nfs/dbraw/zinc/97/11/18/565971118.db2.gz	PUWUTDZHAWHVDC-ZDUSSCGKSA-N	-2	1	383.447	2.723	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)ccc1Cl	ZINC000610512276	566085298	/nfs/dbraw/zinc/08/52/98/566085298.db2.gz	LRXRTYJWVNFHHK-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COc1ccc(-c2cc3[n-]c(CN4CC[C@H](C(=O)[O-])C4)nc(=O)c3s2)cc1	ZINC000818566638	597534828	/nfs/dbraw/zinc/53/48/28/597534828.db2.gz	YLQLURYJSXXBGC-LBPRGKRZSA-N	-2	1	385.445	2.567	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)N(CC(=O)[O-])C(C)C)cc1	ZINC000262496065	598075085	/nfs/dbraw/zinc/07/50/85/598075085.db2.gz	XINFZJMBEDWLNZ-UHFFFAOYSA-N	-2	1	390.461	2.731	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)NCCCCC(=O)[O-])c2)cc1	ZINC000262464737	598165425	/nfs/dbraw/zinc/16/54/25/598165425.db2.gz	XPOHBZAKEXLAMP-UHFFFAOYSA-N	-2	1	390.461	2.781	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)NC[C@@H](C)C(=O)[O-])ccc2C)cc1	ZINC000485927220	599779324	/nfs/dbraw/zinc/77/93/24/599779324.db2.gz	QHEKQUMZPZUBCA-CQSZACIVSA-N	-2	1	390.461	2.555	20	0		GFADML
COc1ccc(Cl)c(C(=O)[O-])c1NS(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000477419820	599907164	/nfs/dbraw/zinc/90/71/64/599907164.db2.gz	NFEADDOFYWXLPF-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)cc1	ZINC000737076015	600025460	/nfs/dbraw/zinc/02/54/60/600025460.db2.gz	LYQQJEKAMMOYMW-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
O=C([O-])[C@@H]1C[C@H]1C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1	ZINC000739552647	600102906	/nfs/dbraw/zinc/10/29/06/600102906.db2.gz	JHMMTRLKBVMQRO-HUUCEWRRSA-N	-2	1	394.836	2.800	20	0		GFADML
CC(C)OC(=O)NCc1ccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])cc1	ZINC000736484816	600254355	/nfs/dbraw/zinc/25/43/55/600254355.db2.gz	JTYOXXIIKIJAKS-UHFFFAOYSA-N	-2	1	392.433	2.820	20	0		GFADML
COC(=O)N(C)Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1	ZINC000735268463	600299692	/nfs/dbraw/zinc/29/96/92/600299692.db2.gz	FMABTNIPDRDEDE-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)c(C)c1	ZINC000737703249	600300696	/nfs/dbraw/zinc/30/06/96/600300696.db2.gz	ULLIAXYTBHWNPL-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
CN(Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1)C(=O)[O-]	ZINC000737486656	600300709	/nfs/dbraw/zinc/30/07/09/600300709.db2.gz	TXVDPACQZYEMFS-UHFFFAOYSA-N	-3	1	398.824	2.949	20	0		GFADML
O=C([O-])NCc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000740002599	600303436	/nfs/dbraw/zinc/30/34/36/600303436.db2.gz	XCZFULJLXSOHQA-UHFFFAOYSA-N	-3	1	384.797	2.607	20	0		GFADML
COc1ccc(C(=O)Nc2cccc(C(=O)N3CCCC[C@@H]3C(=O)[O-])c2)c([O-])c1	ZINC000621999836	600485448	/nfs/dbraw/zinc/48/54/48/600485448.db2.gz	VCKDJOAEZUTVQW-QGZVFWFLSA-N	-2	1	398.415	2.732	20	0		GFADML
CC(C)(C)[C@@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1)C(=O)[O-]	ZINC000675985158	600528735	/nfs/dbraw/zinc/52/87/35/600528735.db2.gz	XULQLDFADLKRHA-INIZCTEOSA-N	-2	1	390.461	2.717	20	0		GFADML
CCn1ncc2ccc([N-]S(=O)(=O)c3ccc(OC)c(C(=O)[O-])c3)cc21	ZINC000500289325	600544036	/nfs/dbraw/zinc/54/40/36/600544036.db2.gz	KUHVMCXQZKLENF-UHFFFAOYSA-N	-2	1	375.406	2.564	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)ccc1OC	ZINC000737681042	600544632	/nfs/dbraw/zinc/54/46/32/600544632.db2.gz	PAOWHVVMTONZHF-UHFFFAOYSA-N	-2	1	398.368	2.512	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-n3cnc4ccccc43)cc2)c[nH]1	ZINC000509653353	600672451	/nfs/dbraw/zinc/67/24/51/600672451.db2.gz	RRZRPIJJNXEOPE-UHFFFAOYSA-N	-2	1	382.401	2.853	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(COCc3ccco3)c2)c[nH]1	ZINC000509537216	600675688	/nfs/dbraw/zinc/67/56/88/600675688.db2.gz	JXKXCISXSNDSCO-UHFFFAOYSA-N	-2	1	376.390	2.824	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(CSC3CCOCC3)c2)c[nH]1	ZINC000523837241	600682381	/nfs/dbraw/zinc/68/23/81/600682381.db2.gz	AYKIPQBTRIZRMA-UHFFFAOYSA-N	-2	1	396.490	2.926	20	0		GFADML
O=C([O-])c1ccc(Br)c(S(=O)(=O)[N-]c2c(O)cccc2F)c1	ZINC000738679968	600683749	/nfs/dbraw/zinc/68/37/49/600683749.db2.gz	ZIMIQFIPORWVAJ-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
CCc1nnc(-c2ccc([N-]S(=O)(=O)c3ccc(O)c(C(=O)[O-])c3)cc2)o1	ZINC000830328157	600690905	/nfs/dbraw/zinc/69/09/05/600690905.db2.gz	KZYQUMZYOXLORY-UHFFFAOYSA-N	-2	1	389.389	2.504	20	0		GFADML
Cc1cccc([C@@H](C)CNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000738690505	600791253	/nfs/dbraw/zinc/79/12/53/600791253.db2.gz	LDMBCSYDKVPEEH-HNNXBMFYSA-N	-2	1	393.443	2.635	20	0		GFADML
Cc1ccc(C(=O)N(C)C)cc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000506721442	600888647	/nfs/dbraw/zinc/88/86/47/600888647.db2.gz	BOQANTAOUGXZEJ-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(OC)cc2C(=O)[O-])c1	ZINC000504666565	600890186	/nfs/dbraw/zinc/89/01/86/600890186.db2.gz	VZCQGQCCCUABOK-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)c2)n[nH]1	ZINC000484641648	601205339	/nfs/dbraw/zinc/20/53/39/601205339.db2.gz	QSXUWAXVHNRAEF-UHFFFAOYSA-N	-2	1	386.433	2.516	20	0		GFADML
CCC1CCC(NC(=O)Cc2c(C)nc(-c3cccnc3)[n-]c2=O)(C(=O)[O-])CC1	ZINC000263002669	601295863	/nfs/dbraw/zinc/29/58/63/601295863.db2.gz	VFUDSPQVEUIFLE-UHFFFAOYSA-N	-2	1	398.463	2.635	20	0		GFADML
COc1ccc(NC(=O)Nc2cccc(NC(=O)[O-])c2)cc1[N-]S(C)(=O)=O	ZINC000832404124	601312692	/nfs/dbraw/zinc/31/26/92/601312692.db2.gz	HVXRGNKSVJBIFR-UHFFFAOYSA-N	-2	1	394.409	2.801	20	0		GFADML
COC(=O)/C=C\c1ccc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2C)cc1	ZINC000747613635	601322279	/nfs/dbraw/zinc/32/22/79/601322279.db2.gz	SHCUWWXVCOLKBU-FLIBITNWSA-N	-2	1	375.402	2.680	20	0		GFADML
Cc1ccc(NC(=O)C2CC2)cc1[N-]S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000738280037	601323214	/nfs/dbraw/zinc/32/32/14/601323214.db2.gz	KQHWKHCBNXJVIR-UHFFFAOYSA-N	-2	1	392.408	2.982	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000829799306	601323313	/nfs/dbraw/zinc/32/33/13/601323313.db2.gz	GNECXWKEMQAQDN-YRNVUSSQSA-N	-2	1	388.445	2.643	20	0		GFADML
CSc1cc2c(cc1[N-]S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1)OCCO2	ZINC000738144067	601328882	/nfs/dbraw/zinc/32/88/82/601328882.db2.gz	NBRVVBXZZOAVDD-UHFFFAOYSA-N	-2	1	399.421	2.818	20	0		GFADML
CCCCC[C@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000829339628	601404155	/nfs/dbraw/zinc/40/41/55/601404155.db2.gz	KUHDGPYUQDRSBT-VIFPVBQESA-N	-2	1	399.694	2.809	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc(NS(=O)(=O)c2ccc(Cl)nc2C(=O)[O-])cc1	ZINC000826127462	601484728	/nfs/dbraw/zinc/48/47/28/601484728.db2.gz	VKVJGDADNRUNOU-UHFFFAOYSA-N	-2	1	398.824	2.596	20	0		GFADML
COc1ccc(CCC(=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000477422436	601488014	/nfs/dbraw/zinc/48/80/14/601488014.db2.gz	FDCWMURMHZKHEQ-UHFFFAOYSA-N	-2	1	393.417	2.520	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1C	ZINC000443364332	601575949	/nfs/dbraw/zinc/57/59/49/601575949.db2.gz	PCBLASLDJGFCST-UHFFFAOYSA-N	-2	1	393.417	2.981	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccn(-c3ccncc3)n2)c(Cl)cc1F	ZINC000071092331	601769587	/nfs/dbraw/zinc/76/95/87/601769587.db2.gz	WWECPKRFMXNFSS-UHFFFAOYSA-N	-2	1	396.787	2.559	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3cccc(C)c3C(=O)[O-])ccc2o1	ZINC000831795937	601795175	/nfs/dbraw/zinc/79/51/75/601795175.db2.gz	UFOAQKQEWRYBAL-UHFFFAOYSA-N	-2	1	390.417	2.824	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CCC(=O)N1CCC(CCC(=O)[O-])CC1	ZINC000663128823	601817648	/nfs/dbraw/zinc/81/76/48/601817648.db2.gz	MMDMVUUOPVVSHL-UHFFFAOYSA-N	-2	1	398.463	2.589	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3cc(F)c(F)c(C(=O)[O-])c3)c2)no1	ZINC000370272922	601837350	/nfs/dbraw/zinc/83/73/50/601837350.db2.gz	NVHBLEGHNKAIAN-UHFFFAOYSA-N	-2	1	395.343	2.822	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1cccc(Cn2cccn2)c1	ZINC000833295506	601858471	/nfs/dbraw/zinc/85/84/71/601858471.db2.gz	ZEOVMTGAJUIIPS-UHFFFAOYSA-N	-2	1	375.381	2.570	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc(C(=O)[O-])c1F	ZINC000832903442	601986088	/nfs/dbraw/zinc/98/60/88/601986088.db2.gz	CZULHKWMNHLJAV-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CC(C)C[C@H]1CCCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000826832684	602060853	/nfs/dbraw/zinc/06/08/53/602060853.db2.gz	USVYNBFBNSPTGU-GOSISDBHSA-N	-2	1	385.464	2.834	20	0		GFADML
Cc1ccc(C(=O)NC(C)(C)C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(F)cc1	ZINC000832911189	602117945	/nfs/dbraw/zinc/11/79/45/602117945.db2.gz	HENAONFEZDDBIU-UHFFFAOYSA-N	-2	1	394.424	2.528	20	0		GFADML
Cc1nc([C@@H](C)[N-]S(=O)(=O)c2cc(C(=O)[O-])oc2Br)cs1	ZINC000832993876	602154934	/nfs/dbraw/zinc/15/49/34/602154934.db2.gz	JEHHLLTVYSEVEO-RXMQYKEDSA-N	-2	1	395.256	2.545	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1F	ZINC000831435061	602321070	/nfs/dbraw/zinc/32/10/70/602321070.db2.gz	MUFIXZWFNFUZTR-WTKPLQERSA-N	-2	1	379.365	2.511	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)ccc1F	ZINC000754759618	602322755	/nfs/dbraw/zinc/32/27/55/602322755.db2.gz	SSISZYIQANOIKO-UHFFFAOYSA-N	-2	1	385.344	2.641	20	0		GFADML
Cc1cc(C)n(-c2ccc(CNC(=O)c3ccc(NC(=O)[O-])cc3[O-])cn2)n1	ZINC000740065553	602851374	/nfs/dbraw/zinc/85/13/74/602851374.db2.gz	BTHRUIDUGXQKPB-UHFFFAOYSA-N	-2	1	381.392	2.610	20	0		GFADML
COc1cc2c(cc1OC)CCN(C(=O)c1ccc(NC(=O)[O-])cc1[O-])CC2	ZINC000739874351	602852411	/nfs/dbraw/zinc/85/24/11/602852411.db2.gz	UYLGZWPZKPYJRW-UHFFFAOYSA-N	-2	1	386.404	2.740	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2ccc(N3CCCCC3=O)cc2)c([O-])c1	ZINC000740699285	602853435	/nfs/dbraw/zinc/85/34/35/602853435.db2.gz	WPKQYPTXNPSBLU-UHFFFAOYSA-N	-2	1	383.404	2.929	20	0		GFADML
CN(C(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000739593530	602858735	/nfs/dbraw/zinc/85/87/35/602858735.db2.gz	OJZSBPOAEFQRRL-ZDUSSCGKSA-N	-2	1	393.440	2.954	20	0		GFADML
CC(C)[C@H](CNC(=O)c1ccc(NC(=O)[O-])cc1[O-])NC(=O)OC(C)(C)C	ZINC000738791226	602864334	/nfs/dbraw/zinc/86/43/34/602864334.db2.gz	SSUNVMJAGNLNKG-ZDUSSCGKSA-N	-2	1	381.429	2.761	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCCc2csc(N3CCCC3)n2)c([O-])c1	ZINC000740698571	602866455	/nfs/dbraw/zinc/86/64/55/602866455.db2.gz	OJBOUCAOYXYOOQ-UHFFFAOYSA-N	-2	1	376.438	2.511	20	0		GFADML
O=C([O-])NC[C@@H]([N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C1CC1	ZINC000740611841	603069554	/nfs/dbraw/zinc/06/95/54/603069554.db2.gz	HMRADGWZSSLONB-SNVBAGLBSA-N	-2	1	386.779	2.683	20	0		GFADML
O=C([O-])N1CCC[C@@H]([N-]S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)C1	ZINC000739927469	603086195	/nfs/dbraw/zinc/08/61/95/603086195.db2.gz	PANLRDGCLGYFGQ-MRVPVSSYSA-N	-2	1	386.779	2.780	20	0		GFADML
CCC[C@H](NC(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000739321721	603233914	/nfs/dbraw/zinc/23/39/14/603233914.db2.gz	KZTFPEWSWUGKQO-INIZCTEOSA-N	-2	1	391.449	2.862	20	0		GFADML
O=C([O-])N[C@@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)Cc1ccccc1	ZINC000832105539	603474284	/nfs/dbraw/zinc/47/42/84/603474284.db2.gz	OMKXNTWZUYETRV-MRXNPFEDSA-N	-2	1	380.404	2.990	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])c1	ZINC000828772210	604013901	/nfs/dbraw/zinc/01/39/01/604013901.db2.gz	LVVAMAKCOBOLRJ-UHFFFAOYSA-N	-2	1	390.417	2.623	20	0		GFADML
CCC[C@H](C)[C@@H]1CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829208096	604342571	/nfs/dbraw/zinc/34/25/71/604342571.db2.gz	IKQJLFKTFMZTJO-KSSFIOAISA-N	-2	1	385.464	2.834	20	0		GFADML
O=C([O-])C[C@H]1CCCN1C(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1	ZINC000262959981	604593478	/nfs/dbraw/zinc/59/34/78/604593478.db2.gz	NSMGPSHHAZUGHS-MRXNPFEDSA-N	-2	1	388.445	2.567	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2)c(OC)c1C(=O)[O-]	ZINC000833734376	604861257	/nfs/dbraw/zinc/86/12/57/604861257.db2.gz	AFHFNDXNWHSDKE-UHFFFAOYSA-N	-2	1	395.433	2.990	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2n[nH]c(-c3ccccc3)c2C)cc1C(=O)[O-]	ZINC000833734500	604884939	/nfs/dbraw/zinc/88/49/39/604884939.db2.gz	IMKBTUNBHSGDFQ-UHFFFAOYSA-N	-2	1	387.417	2.893	20	0		GFADML
O=C([O-])CCOc1ccc(S(=O)(=O)[N-]c2ccc(-c3ncco3)cc2)cc1	ZINC000833774921	605153012	/nfs/dbraw/zinc/15/30/12/605153012.db2.gz	NHXUKKPMRYWLPV-UHFFFAOYSA-N	-2	1	388.401	2.996	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)Nc2ccc(F)c(NC(=O)[O-])c2)cc1C(=O)[O-]	ZINC000833744413	605168155	/nfs/dbraw/zinc/16/81/55/605168155.db2.gz	GCUBKIYFHOXQKI-UHFFFAOYSA-N	-2	1	386.332	2.862	20	0		GFADML
COCCN(C(=O)c1ccc(NC(=O)[O-])cc1[O-])c1ccc(OC)c(OC)c1	ZINC000833882775	605652440	/nfs/dbraw/zinc/65/24/40/605652440.db2.gz	APANIZZXTQXTLZ-UHFFFAOYSA-N	-2	1	390.392	2.793	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])[C@@H](C)CN1C(=O)OC(C)(C)C	ZINC000833836325	605837115	/nfs/dbraw/zinc/83/71/15/605837115.db2.gz	NDAAHHRLXIWCNP-RYUDHWBXSA-N	-2	1	393.440	2.952	20	0		GFADML
CC(C)[C@@H](C(=O)[O-])[C@H](C)[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000819089368	660246249	/nfs/dbraw/zinc/24/62/49/660246249.db2.gz	OHXKNZHIAVPSRJ-OIBJUYFYSA-N	-2	1	399.694	2.521	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2ccc(Cl)c(F)c2)cc(C(=O)[O-])c1OC	ZINC000042794441	654644785	/nfs/dbraw/zinc/64/47/85/654644785.db2.gz	MQYMGHCURLCGBC-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
Cc1ccc(Cl)cc1S(=O)(=O)[N-]NC(=O)c1ccc(Cl)cc1[O-]	ZINC000055664797	654779836	/nfs/dbraw/zinc/77/98/36/654779836.db2.gz	SLRYCNNDUDORCJ-UHFFFAOYSA-N	-2	1	375.233	2.631	20	0		GFADML
CN(CC(F)F)C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000103524744	655074338	/nfs/dbraw/zinc/07/43/38/655074338.db2.gz	SIXQMFYOHIHAOO-UHFFFAOYSA-N	-2	1	376.406	2.592	20	0		GFADML
Cc1cc(C(N)=O)ccc1[N-]S(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1C	ZINC000327125449	655385677	/nfs/dbraw/zinc/38/56/77/655385677.db2.gz	KCGREHBXJSOBEL-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C([O-])[C@@H](O)[C@H](CC1CCCCC1)[N-]S(=O)(=O)c1cc(Cl)ccc1F	ZINC000578017292	655471213	/nfs/dbraw/zinc/47/12/13/655471213.db2.gz	XJTRSKKBIHPJTJ-ZFWWWQNUSA-N	-2	1	393.864	2.542	20	0		GFADML
CC[C@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])c(F)cc1F)CC(F)(F)F	ZINC000840899707	661204152	/nfs/dbraw/zinc/20/41/52/661204152.db2.gz	QODBACQOQUVMEJ-ZETCQYMHSA-N	-2	1	375.315	2.920	20	0		GFADML
C[C@H]1CCCC[C@H]1OCC[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F	ZINC000761262530	656005897	/nfs/dbraw/zinc/00/58/97/656005897.db2.gz	FSFCUSPZUYITHJ-GXFFZTMASA-N	-2	1	377.409	2.537	20	0		GFADML
O=C([O-])c1cc(Cl)c(Cl)c(S(=O)(=O)[N-]c2ccc3n[nH]nc3c2)c1	ZINC000761901136	656023849	/nfs/dbraw/zinc/02/38/49/656023849.db2.gz	PZSQSBHZQSWQHQ-UHFFFAOYSA-N	-2	1	387.204	2.764	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2c(F)cccc2CO)c(Cl)cc1F	ZINC000762472452	656043319	/nfs/dbraw/zinc/04/33/19/656043319.db2.gz	BJJRCRJZTCSTOP-UHFFFAOYSA-N	-2	1	377.752	2.610	20	0		GFADML
CC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)c1	ZINC000767738008	656217981	/nfs/dbraw/zinc/21/79/81/656217981.db2.gz	VUXNTZPQKCDWIA-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(C)cc(C(=O)[O-])c2)ccc1Cl	ZINC000795365155	658811595	/nfs/dbraw/zinc/81/15/95/658811595.db2.gz	GJAAYDZGOFFDLI-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1cnc([C@@H](C)C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)s1	ZINC000871940724	662744241	/nfs/dbraw/zinc/74/42/41/662744241.db2.gz	COMFPFBHHGFUKN-ZETCQYMHSA-N	-2	1	376.406	2.510	20	0		GFADML
N#Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Br)s1	ZINC000230325198	553065154	/nfs/dbraw/zinc/06/51/54/553065154.db2.gz	RAMQNBKLOHDYKO-UHFFFAOYSA-N	-2	1	387.236	2.881	20	0		GFADML
CSCC[C@H]([N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl)C(=O)[O-]	ZINC000231725277	553066110	/nfs/dbraw/zinc/06/61/10/553066110.db2.gz	YYXYFRIWAPSCPN-ZETCQYMHSA-N	-2	1	376.258	2.617	20	0		GFADML
CCC[C@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000262668999	553173971	/nfs/dbraw/zinc/17/39/71/553173971.db2.gz	OOUOPZCDLZZYBC-YFKPBYRVSA-N	-2	1	376.681	2.696	20	0		GFADML
CC(C)(CC[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000424386233	563377580	/nfs/dbraw/zinc/37/75/80/563377580.db2.gz	DVIAKMPOQYRKNF-UHFFFAOYSA-N	-2	1	386.214	2.507	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])cc1OC	ZINC000327556260	563458511	/nfs/dbraw/zinc/45/85/11/563458511.db2.gz	BYFJWANVQXUQRH-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(OC)c2)cc1CC(=O)[O-]	ZINC000432479859	563585123	/nfs/dbraw/zinc/58/51/23/563585123.db2.gz	UDNMCVGYVDQRNU-UHFFFAOYSA-N	-2	1	385.825	2.785	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(N3CCC3=O)cc2)cc1Cl	ZINC000410418326	563590742	/nfs/dbraw/zinc/59/07/42/563590742.db2.gz	NNEAQIXXHRJBCS-UHFFFAOYSA-N	-2	1	380.809	2.576	20	0		GFADML
O=C(N[C@@H]1CCCSC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436571783	563674133	/nfs/dbraw/zinc/67/41/33/563674133.db2.gz	DUHOFQYJIUPOCW-GFCCVEGCSA-N	-2	1	398.531	2.880	20	0		GFADML
O=C([O-])c1ccc([O-])c(S(=O)(=O)Nc2ccc(OC(F)F)c(F)c2)c1	ZINC000436995270	563687854	/nfs/dbraw/zinc/68/78/54/563687854.db2.gz	QIZMPLAFRXGSHM-UHFFFAOYSA-N	-2	1	377.296	2.632	20	0		GFADML
Cc1oc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(S[C@H](C)C(=O)[O-])cc1	ZINC000507600054	564234242	/nfs/dbraw/zinc/23/42/42/564234242.db2.gz	BUKIFYPOFFXHQY-SECBINFHSA-N	-2	1	385.419	2.652	20	0		GFADML
CC[C@](C)(C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000547576612	564496468	/nfs/dbraw/zinc/49/64/68/564496468.db2.gz	WXUYYLZXQLNFSU-GFCCVEGCSA-N	-2	1	386.214	2.507	20	0		GFADML
CCC(CC)CS(=O)(=O)[N-]c1c(C(=O)[O-])cc(OC)c(OC)c1OC	ZINC000547870420	564514263	/nfs/dbraw/zinc/51/42/63/564514263.db2.gz	ANFISCHMYTXLPJ-UHFFFAOYSA-N	-2	1	375.443	2.589	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1Cl	ZINC000481972054	564530884	/nfs/dbraw/zinc/53/08/84/564530884.db2.gz	IMILSCITIDZXRI-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
Cc1cc(Cl)c([N-]S(=O)(=O)c2cnn(CC(F)F)c2)c(C(=O)[O-])c1	ZINC000548619586	564567479	/nfs/dbraw/zinc/56/74/79/564567479.db2.gz	JGSUOOHFPVOZFG-UHFFFAOYSA-N	-2	1	379.772	2.609	20	0		GFADML
CC1(C)C[C@@H]([N-]S(=O)(=O)c2csnc2C(=O)[O-])c2ccc(F)cc2O1	ZINC000579468795	564748468	/nfs/dbraw/zinc/74/84/68/564748468.db2.gz	KXQSAOFVFPXSBO-SNVBAGLBSA-N	-2	1	386.426	2.561	20	0		GFADML
O=C([O-])CCCC[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F	ZINC000530353942	564877500	/nfs/dbraw/zinc/87/75/00/564877500.db2.gz	GGQVKGCNIWAFRK-UHFFFAOYSA-N	-2	1	388.642	2.775	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])cc(C(=O)[O-])c2)c(Cl)c1	ZINC000583346876	564887547	/nfs/dbraw/zinc/88/75/47/564887547.db2.gz	MNLCWEPFGOYNNG-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)cc1C	ZINC000610192614	566070075	/nfs/dbraw/zinc/07/00/75/566070075.db2.gz	AMZVFMPWVGGBPB-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC(C)(C[N-]S(=O)(=O)c1cc(Br)sc1Cl)CC(=O)[O-]	ZINC000681576338	566114792	/nfs/dbraw/zinc/11/47/92/566114792.db2.gz	CUXPXIOMMYBGBV-UHFFFAOYSA-N	-2	1	390.708	2.943	20	0		GFADML
O=C([O-])Cc1ccccc1[N-]S(=O)(=O)c1cc(Cl)c(F)c(C(=O)[O-])c1	ZINC000819626075	597255660	/nfs/dbraw/zinc/25/56/60/597255660.db2.gz	DXAXXMNMILMUEU-UHFFFAOYSA-N	-3	1	387.772	2.605	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(C(=O)N(C)[C@@H](C)C(=O)[O-])cc2)c1	ZINC000262926335	597458350	/nfs/dbraw/zinc/45/83/50/597458350.db2.gz	WKDFYGPSHHFYCT-AWEZNQCLSA-N	-2	1	390.461	2.649	20	0		GFADML
COC(=O)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1Cl	ZINC000737717046	599814209	/nfs/dbraw/zinc/81/42/09/599814209.db2.gz	GRBUWRJERYSUQF-UHFFFAOYSA-N	-2	1	375.811	2.687	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2cc(C(=O)OC)sc2C(=O)[O-])c(C)c1	ZINC000737203364	599815519	/nfs/dbraw/zinc/81/55/19/599815519.db2.gz	LGMJTHMQPQFSAI-UHFFFAOYSA-N	-2	1	399.446	2.741	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C)c2)ccc1F	ZINC000728509385	599925692	/nfs/dbraw/zinc/92/56/92/599925692.db2.gz	KJQLJWBSOMXAAH-UHFFFAOYSA-N	-2	1	381.381	2.810	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])c(C)c1	ZINC000737820900	600097866	/nfs/dbraw/zinc/09/78/66/600097866.db2.gz	JJIQFUMRNUDTKE-UHFFFAOYSA-N	-2	1	383.397	2.658	20	0		GFADML
O=C([O-])Nc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc3c2CCC3)ccc1F	ZINC000740011403	600101725	/nfs/dbraw/zinc/10/17/25/600101725.db2.gz	CHFLCNHBHCCDBN-UHFFFAOYSA-N	-3	1	394.380	2.903	20	0		GFADML
CN(C)C(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000063180346	600482886	/nfs/dbraw/zinc/48/28/86/600482886.db2.gz	AEUXKUPQYNCITG-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2SC)cc1C(=O)[O-]	ZINC000055577536	600542327	/nfs/dbraw/zinc/54/23/27/600542327.db2.gz	XNUPWZRKBPFJCL-UHFFFAOYSA-N	-3	1	397.430	2.614	20	0		GFADML
CCCc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)OC)c(C(=O)[O-])c2)cc1	ZINC000829566406	600687977	/nfs/dbraw/zinc/68/79/77/600687977.db2.gz	LEVYGOSJVRDEHR-UHFFFAOYSA-N	-2	1	377.418	2.925	20	0		GFADML
CCCc1cc(=O)[n-]c(S[C@@H]2CCN(c3sccc3C(=O)[O-])C2=O)n1	ZINC000829566399	600804343	/nfs/dbraw/zinc/80/43/43/600804343.db2.gz	LCQTZHTWPKMZTR-LLVKDONJSA-N	-2	1	379.463	2.792	20	0		GFADML
CN(C)C(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000737357129	600888026	/nfs/dbraw/zinc/88/80/26/600888026.db2.gz	ZFOPCZVFMCSYDG-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)CS3)c1	ZINC000740306979	600888788	/nfs/dbraw/zinc/88/87/88/600888788.db2.gz	KRBKJJOWEFBHKG-UHFFFAOYSA-N	-2	1	398.849	2.883	20	0		GFADML
CN1C(=O)CCc2cc([N-]S(=O)(=O)c3cc(Cl)cc(C(=O)[O-])c3)ccc21	ZINC000737510118	600893355	/nfs/dbraw/zinc/89/33/55/600893355.db2.gz	VLICYIRYCFMWMW-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)c1	ZINC000737654701	600894444	/nfs/dbraw/zinc/89/44/44/600894444.db2.gz	WNRRRVZEGQMJAA-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COc1cc(S(=O)(=O)Nc2ccc(C)c(C(=O)[O-])c2)c(Cl)cc1C(=O)[O-]	ZINC000485264141	601224046	/nfs/dbraw/zinc/22/40/46/601224046.db2.gz	WQZLGYAXEOLGCW-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)c1	ZINC000432208730	601234884	/nfs/dbraw/zinc/23/48/84/601234884.db2.gz	STIWKHWTWRHBGT-UHFFFAOYSA-N	-2	1	395.433	2.610	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCN(c2ccc(C(=O)[O-])cc2)C[C@@H]1C	ZINC000832994330	601280043	/nfs/dbraw/zinc/28/00/43/601280043.db2.gz	SKDPZVZTOIDNFR-ZDUSSCGKSA-N	-2	1	398.463	2.663	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)NCc1ccc(OCCCC(=O)[O-])cc1	ZINC000832994300	601286902	/nfs/dbraw/zinc/28/69/02/601286902.db2.gz	PWTFVRFEOLJIPE-UHFFFAOYSA-N	-2	1	387.436	2.788	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1OC	ZINC000032506267	601318909	/nfs/dbraw/zinc/31/89/09/601318909.db2.gz	YRVWEUMRVQKCPP-IZZDOVSWSA-N	-2	1	377.418	2.993	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1C	ZINC000028249271	601320789	/nfs/dbraw/zinc/32/07/89/601320789.db2.gz	RNBIQPZNRHEAIS-DHZHZOJOSA-N	-2	1	375.402	2.680	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1C	ZINC000028249543	601321119	/nfs/dbraw/zinc/32/11/19/601321119.db2.gz	AYCJNZXXYOGOOJ-UHFFFAOYSA-N	-2	1	377.418	2.897	20	0		GFADML
CCOCCOCc1cccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000055633261	601323778	/nfs/dbraw/zinc/32/37/78/601323778.db2.gz	YMXHZKXBQVYONL-UHFFFAOYSA-N	-2	1	397.424	2.878	20	0		GFADML
COCCOc1cccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000831783134	601324797	/nfs/dbraw/zinc/32/47/97/601324797.db2.gz	FJTLUSZFCRXIOP-JXMROGBWSA-N	-2	1	377.418	2.610	20	0		GFADML
CCCNC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1	ZINC000614868639	601325994	/nfs/dbraw/zinc/32/59/94/601325994.db2.gz	AWAUKFRRSWWYDE-UHFFFAOYSA-N	-2	1	390.461	2.942	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1c(F)cccc1-n1cccn1	ZINC000730203935	601331032	/nfs/dbraw/zinc/33/10/32/601331032.db2.gz	GHKSKWBZPOQBRP-UHFFFAOYSA-N	-2	1	391.380	2.519	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)ccc1F	ZINC000831348353	601332871	/nfs/dbraw/zinc/33/28/71/601332871.db2.gz	FESXCYGKZJXGTD-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CCc1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c(C(=O)[O-])c1	ZINC000751143389	601483785	/nfs/dbraw/zinc/48/37/85/601483785.db2.gz	PUMDVHPYARXQGZ-UHFFFAOYSA-N	-3	1	385.344	2.724	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)N[C@@H](c1ccccc1)[C@@H](C)C(=O)[O-]	ZINC000833003988	601608472	/nfs/dbraw/zinc/60/84/72/601608472.db2.gz	DWNQMBLVFVJQPW-MPBGBICISA-N	-2	1	396.447	2.563	20	0		GFADML
CC[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)cc1)C(=O)[O-]	ZINC000262957011	601749249	/nfs/dbraw/zinc/74/92/49/601749249.db2.gz	JSEXVSQWDRNMFY-KRWDZBQOSA-N	-2	1	390.461	2.697	20	0		GFADML
Cc1ccc([C@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)cc1F	ZINC000832921576	601776433	/nfs/dbraw/zinc/77/64/33/601776433.db2.gz	SDXWJWUZKOFGHW-ZDUSSCGKSA-N	-2	1	397.406	2.731	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccc(Cl)c(C(=O)[O-])c3)c2)n[nH]1	ZINC000376522196	601828331	/nfs/dbraw/zinc/82/83/31/601828331.db2.gz	WCLPDIYBBVRFLB-UHFFFAOYSA-N	-2	1	392.824	2.933	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(OC)ccc2C(=O)[O-])ccc1Cl	ZINC000757473399	601829962	/nfs/dbraw/zinc/82/99/62/601829962.db2.gz	NCBZSEMUUSCMOL-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(-c3cc[nH]n3)c2)cc(F)c1F	ZINC000751147286	601834170	/nfs/dbraw/zinc/83/41/70/601834170.db2.gz	TXLLGSGBXXAKQG-UHFFFAOYSA-N	-2	1	379.344	2.854	20	0		GFADML
Cc1cnn(-c2ccc(S(=O)(=O)[N-]c3cccc(F)c3C(=O)[O-])cc2F)c1	ZINC000466358535	601860418	/nfs/dbraw/zinc/86/04/18/601860418.db2.gz	XGQXAONOLDHDQN-UHFFFAOYSA-N	-2	1	393.371	2.958	20	0		GFADML
COC(=O)N(C)Cc1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000831198277	601862866	/nfs/dbraw/zinc/86/28/66/601862866.db2.gz	DPOWRKCZEVJKMU-UHFFFAOYSA-N	-2	1	396.396	2.523	20	0		GFADML
CC(C)c1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(CC(=O)[O-])c1	ZINC000462109387	601988229	/nfs/dbraw/zinc/98/82/29/601988229.db2.gz	QDIKRJASVCQDOR-UHFFFAOYSA-N	-3	1	377.418	2.936	20	0		GFADML
O=C([O-])Cc1cccc([N-]S(=O)(=O)c2ccc3c4c(cccc42)C(=O)N3)c1	ZINC000630776943	601988471	/nfs/dbraw/zinc/98/84/71/601988471.db2.gz	FFTPAOWJUFMGPA-UHFFFAOYSA-N	-2	1	382.397	2.833	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)cc1F	ZINC000533626874	602321583	/nfs/dbraw/zinc/32/15/83/602321583.db2.gz	NTKYFHINPYHEFN-UHFFFAOYSA-N	-2	1	378.381	2.600	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2CN(C)C(=O)[O-])c(C)c1	ZINC000739793965	602654765	/nfs/dbraw/zinc/65/47/65/602654765.db2.gz	YUUFMBIATLAMDB-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)cc1	ZINC000739480195	602655064	/nfs/dbraw/zinc/65/50/64/602655064.db2.gz	VIPCWKCZZBLHJH-UHFFFAOYSA-N	-2	1	392.433	2.774	20	0		GFADML
CCCCN(C)C(=O)C1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000739328652	602850675	/nfs/dbraw/zinc/85/06/75/602850675.db2.gz	GNVVDJBYCHYHNN-UHFFFAOYSA-N	-2	1	377.441	2.593	20	0		GFADML
COCCOC(=O)Nc1cccc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])c1	ZINC000739835153	602855286	/nfs/dbraw/zinc/85/52/86/602855286.db2.gz	VEYFSZFEHDSKOW-UHFFFAOYSA-N	-2	1	389.364	2.929	20	0		GFADML
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738706873	602855919	/nfs/dbraw/zinc/85/59/19/602855919.db2.gz	GWMOQFVPGBFSCM-GFCCVEGCSA-N	-2	1	393.440	2.859	20	0		GFADML
Cc1nc(CN2CCCN(C(=O)c3ccc(NC(=O)[O-])cc3[O-])CC2)cs1	ZINC000740219288	602861827	/nfs/dbraw/zinc/86/18/27/602861827.db2.gz	OHOBTHUMUMKILA-UHFFFAOYSA-N	-2	1	390.465	2.595	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NC[C@H]2CCCN2C(=O)[O-])c([O-])c1	ZINC000738723014	602862791	/nfs/dbraw/zinc/86/27/91/602862791.db2.gz	KFQBMXFDCAVCSJ-GFCCVEGCSA-N	-2	1	379.413	2.611	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000739167581	602870025	/nfs/dbraw/zinc/87/00/25/602870025.db2.gz	MQKDLGSUGOVBNZ-FZMZJTMJSA-N	-2	1	393.440	2.857	20	0		GFADML
COCCc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN(C(=O)[O-])C3)cc1	ZINC000739836598	603182363	/nfs/dbraw/zinc/18/23/63/603182363.db2.gz	HCPAZQDRZYEIAI-UHFFFAOYSA-N	-2	1	390.461	2.712	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN(C(=O)[O-])C3)cc1OC	ZINC000739932966	603182923	/nfs/dbraw/zinc/18/29/23/603182923.db2.gz	PIVZXUUDZMXYKQ-UHFFFAOYSA-N	-2	1	392.433	2.541	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)Nc1ccc([C@H](C)NC(=O)[O-])cc1	ZINC000830784908	603194442	/nfs/dbraw/zinc/19/44/42/603194442.db2.gz	FSJBWJVCVMZCOU-JTQLQIEISA-N	-2	1	383.408	2.562	20	0		GFADML
COc1cc(NC(=O)[O-])c(Cl)cc1C(=O)Nc1n[n-]c(C(F)(F)F)n1	ZINC000829193201	603388315	/nfs/dbraw/zinc/38/83/15/603388315.db2.gz	YQECSUNYQSCXSQ-UHFFFAOYSA-N	-2	1	379.682	2.828	20	0		GFADML
CSc1nc(C)c(CCC(=O)NCCc2ccc(NC(=O)[O-])cc2)c(=O)[n-]1	ZINC000738209877	603454942	/nfs/dbraw/zinc/45/49/42/603454942.db2.gz	NYXVOKCPNAOAQX-UHFFFAOYSA-N	-2	1	390.465	2.594	20	0		GFADML
CC(C)(CNC(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000823969364	603620897	/nfs/dbraw/zinc/62/08/97/603620897.db2.gz	KYOYMLPVBLHNNP-UHFFFAOYSA-N	-2	1	391.449	2.720	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCCc2nc(C(F)(F)F)cs2)c([O-])c1	ZINC000832833236	604027806	/nfs/dbraw/zinc/02/78/06/604027806.db2.gz	JHYJNWOKTRUKPX-UHFFFAOYSA-N	-2	1	375.328	2.930	20	0		GFADML
O=C([O-])C[C@H]1CCCN1C(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000263039471	604593445	/nfs/dbraw/zinc/59/34/45/604593445.db2.gz	VPDMYYQJABLJET-MRXNPFEDSA-N	-2	1	388.445	2.567	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(OC)c3ncccc23)cc1C(=O)[O-]	ZINC000832468774	604621799	/nfs/dbraw/zinc/62/17/99/604621799.db2.gz	OLYZGIQJDMYBHJ-UHFFFAOYSA-N	-2	1	388.401	2.751	20	0		GFADML
CC(C)(C)c1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])nc2)c(C(=O)[O-])c1	ZINC000833448784	604687497	/nfs/dbraw/zinc/68/74/97/604687497.db2.gz	HIQPQNCRRRDACW-UHFFFAOYSA-N	-2	1	378.406	2.576	20	0		GFADML
O=C([O-])[C@@H]1CCCN1C(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-]	ZINC000821458365	604701017	/nfs/dbraw/zinc/70/10/17/604701017.db2.gz	YUYQOXNRNJRZLQ-HNNXBMFYSA-N	-2	1	390.342	2.612	20	0		GFADML
CC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(OCC(=O)[O-])c(Cl)c2)c1	ZINC000825964846	604808437	/nfs/dbraw/zinc/80/84/37/604808437.db2.gz	VYDOCLLBOPHUAN-UHFFFAOYSA-N	-2	1	383.809	2.807	20	0		GFADML
CC(C)NC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000485282173	605161363	/nfs/dbraw/zinc/16/13/63/605161363.db2.gz	DXDKYDVFJGQZKX-UHFFFAOYSA-N	-2	1	395.412	2.855	20	0		GFADML
CC(=O)N1CCc2cc([N-]S(=O)(=O)c3ccc(Cl)cc3C(=O)[O-])ccc21	ZINC000833391522	605167691	/nfs/dbraw/zinc/16/76/91/605167691.db2.gz	LTUTYMZFOGYDPK-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3cc(F)cc(C(=O)[O-])c3)ccc2o1	ZINC000833726983	605167925	/nfs/dbraw/zinc/16/79/25/605167925.db2.gz	YPORQOJVNRCUCZ-UHFFFAOYSA-N	-2	1	380.353	2.612	20	0		GFADML
O=C([O-])N1CC[C@H](C[N-]S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)C1	ZINC000834076827	605425851	/nfs/dbraw/zinc/42/58/51/605425851.db2.gz	CXWQJAYZNRJDQH-MRVPVSSYSA-N	-2	1	386.779	2.637	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2n[nH]cc2-c2ccc3c(c2)OCO3)c([O-])c1	ZINC000834255277	605653277	/nfs/dbraw/zinc/65/32/77/605653277.db2.gz	HJUKUNIKGWWFAT-UHFFFAOYSA-N	-2	1	382.332	2.853	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2C[C@H](O)C[C@@H]2c2ccc(F)c(F)c2)c([O-])c1	ZINC000834256951	605662324	/nfs/dbraw/zinc/66/23/24/605662324.db2.gz	PSHKELUPZQUXIV-IAQYHMDHSA-N	-2	1	378.331	2.708	20	0		GFADML
O=C([N-][N-]S(=O)(=O)c1ccc(SC(F)(F)F)cc1)NC1CCCC1	ZINC000065832930	654888881	/nfs/dbraw/zinc/88/88/81/654888881.db2.gz	UDAGSDVDLPTLQH-UHFFFAOYSA-N	-2	1	383.417	2.734	20	0		GFADML
CC(C)n1c(CNC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)n[n-]c1=S	ZINC000066650162	654911229	/nfs/dbraw/zinc/91/12/29/654911229.db2.gz	YLGKEHXEQVYQRC-UHFFFAOYSA-N	-2	1	376.467	2.763	20	0		GFADML
CCC(=O)C[C@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)[O-]	ZINC000275065941	655214846	/nfs/dbraw/zinc/21/48/46/655214846.db2.gz	VNDDMRQDYLVRFE-JTQLQIEISA-N	-2	1	388.656	2.748	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(C)c(Cl)c(C(=O)[O-])c2)ccc1C(N)=O	ZINC000759097959	655947577	/nfs/dbraw/zinc/94/75/77/655947577.db2.gz	STLUMGCIXCMAJH-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc3nc(Cl)cnc3c2)cc1F	ZINC000776459557	656743626	/nfs/dbraw/zinc/74/36/26/656743626.db2.gz	WIOUYKNPJMBAIJ-UHFFFAOYSA-N	-2	1	381.772	2.921	20	0		GFADML
CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000849457708	661728831	/nfs/dbraw/zinc/72/88/31/661728831.db2.gz	JXHBLGVTJMTXPQ-BDAKNGLRSA-N	-2	1	380.260	2.600	20	0		GFADML
CC(C)OC1CCC([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CC1	ZINC000871924087	662742493	/nfs/dbraw/zinc/74/24/93/662742493.db2.gz	CMIUJFPFXMHRCH-UHFFFAOYSA-N	-2	1	377.409	2.678	20	0		GFADML
CC(C)(C)[C@H]1C[C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CCO1	ZINC000871929663	662743121	/nfs/dbraw/zinc/74/31/21/662743121.db2.gz	FMBHGCPVNRZTFG-GXFFZTMASA-N	-2	1	377.409	2.535	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2C)cc1	ZINC000327000269	563456483	/nfs/dbraw/zinc/45/64/83/563456483.db2.gz	BCGQOMSKAPJYQB-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2C)c1	ZINC000327185198	563456987	/nfs/dbraw/zinc/45/69/87/563456987.db2.gz	ZVKZLAAEYLUHCM-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cn2cccn2)c1	ZINC000327367124	563458120	/nfs/dbraw/zinc/45/81/20/563458120.db2.gz	YKLMZYOOCRUBRE-UHFFFAOYSA-N	-2	1	377.447	2.800	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)ccc1Cl	ZINC000327752812	563459111	/nfs/dbraw/zinc/45/91/11/563459111.db2.gz	MWUHKDRHBNRKSA-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
C[C@]1(F)CCN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C1	ZINC000331814632	563562729	/nfs/dbraw/zinc/56/27/29/563562729.db2.gz	GBBYBGKGKBSJRU-INIZCTEOSA-N	-2	1	384.454	2.829	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(Cl)c2)ccc1F	ZINC000436146393	563664844	/nfs/dbraw/zinc/66/48/44/563664844.db2.gz	AGLZMLFZGFCLBL-UHFFFAOYSA-N	-2	1	389.788	2.752	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)Nc1cccc(C(=O)[O-])c1O	ZINC000436993446	563687507	/nfs/dbraw/zinc/68/75/07/563687507.db2.gz	CEMIYTNLKCRSFA-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
CN(C)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000442316871	563771668	/nfs/dbraw/zinc/77/16/68/563771668.db2.gz	UZQOUOWNGCJRKS-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
COC[C@@H](C)n1ccc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2[O-])n1	ZINC000451033247	564266292	/nfs/dbraw/zinc/26/62/92/564266292.db2.gz	SPLGNDHXRYPUGT-SECBINFHSA-N	-2	1	379.360	2.616	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])cc1	ZINC000541795502	564288805	/nfs/dbraw/zinc/28/88/05/564288805.db2.gz	BZPZSLVVBYCIDD-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
C[C@@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000547609703	564502180	/nfs/dbraw/zinc/50/21/80/564502180.db2.gz	VUAICDGTMUDDOR-YFKPBYRVSA-N	-2	1	376.681	2.696	20	0		GFADML
CC(C)=CCSC[C@@H]([N-]S(=O)(=O)c1ccc(F)c(F)c1F)C(=O)[O-]	ZINC000547613990	564503312	/nfs/dbraw/zinc/50/33/12/564503312.db2.gz	DCDZACOVVZBDIZ-SNVBAGLBSA-N	-2	1	383.413	2.535	20	0		GFADML
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C1CCOCC1	ZINC000547617166	564504080	/nfs/dbraw/zinc/50/40/80/564504080.db2.gz	IKQAWZLGWVLXNU-MRVPVSSYSA-N	-2	1	388.294	2.603	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(F)c(C(=O)[O-])c2)cc1Cl	ZINC000481978707	564530545	/nfs/dbraw/zinc/53/05/45/564530545.db2.gz	DYYLYDZYNBHAHJ-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
O=C([O-])[C@@H](Cc1ccco1)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F	ZINC000548591452	564564530	/nfs/dbraw/zinc/56/45/30/564564530.db2.gz	FGVNEGSZZUQHMQ-LLVKDONJSA-N	-2	1	397.758	2.926	20	0		GFADML
CC(C)=CCSC[C@@H]([N-]S(=O)(=O)c1cc(F)c(F)cc1F)C(=O)[O-]	ZINC000548591714	564564766	/nfs/dbraw/zinc/56/47/66/564564766.db2.gz	MFAGTTNWSXPSBB-GFCCVEGCSA-N	-2	1	383.413	2.535	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)[C@H](C)C(=O)[O-]	ZINC000571997150	564576492	/nfs/dbraw/zinc/57/64/92/564576492.db2.gz	UDFGQLLRMMIWCX-NTSWFWBYSA-N	-2	1	388.642	2.629	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2F)c(Cl)c1	ZINC000484534280	564590058	/nfs/dbraw/zinc/59/00/58/564590058.db2.gz	KMMNPOPVMWOGSP-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])c(C)c1	ZINC000523122905	564662115	/nfs/dbraw/zinc/66/21/15/564662115.db2.gz	BMQLKWOSSVEGDE-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1cc(F)cc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)c1F	ZINC000527277470	564736263	/nfs/dbraw/zinc/73/62/63/564736263.db2.gz	PWEYZXHOHCXWLM-UHFFFAOYSA-N	-2	1	391.373	2.620	20	0		GFADML
COC(=O)c1cccc(Cl)c1S(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1F	ZINC000556347477	564819655	/nfs/dbraw/zinc/81/96/55/564819655.db2.gz	KGWPAERYGBPKOG-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COc1ccccc1[C@@H](CC(C)C)[N-]S(=O)(=O)c1csnc1C(=O)[O-]	ZINC000582418380	564845304	/nfs/dbraw/zinc/84/53/04/564845304.db2.gz	VVZXTXSWKYLCFW-GFCCVEGCSA-N	-2	1	384.479	2.916	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2cc(Br)c(Cl)cc2Cl)CC1	ZINC000669668379	565697931	/nfs/dbraw/zinc/69/79/31/565697931.db2.gz	TXIOKIUWMVYRRX-UHFFFAOYSA-N	-2	1	389.054	2.651	20	0		GFADML
C[C@@H]1CC[C@](C[N-]S(=O)(=O)c2ncccc2C(F)(F)F)(CC(=O)[O-])C1	ZINC000650412966	565818141	/nfs/dbraw/zinc/81/81/41/565818141.db2.gz	WDBRZSMNGBFZLA-QMTHXVAHSA-N	-2	1	380.388	2.660	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc1Cl	ZINC000609819257	566053516	/nfs/dbraw/zinc/05/35/16/566053516.db2.gz	FAIGBVIOYSANAE-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1cc(Cl)c(Cl)cc1Br)C(=O)[O-]	ZINC000656509248	566128673	/nfs/dbraw/zinc/12/86/73/566128673.db2.gz	PGUOOIWQUPMQBB-QMMMGPOBSA-N	-2	1	391.070	2.897	20	0		GFADML
NC(=O)CCSc1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1[O-]	ZINC000436476600	569966286	/nfs/dbraw/zinc/96/62/86/569966286.db2.gz	JMWKCAKERJCZBJ-UHFFFAOYSA-N	-2	1	386.882	2.814	20	0		GFADML
O=C([O-])CNC(=O)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1[O-]	ZINC000740484840	597028569	/nfs/dbraw/zinc/02/85/69/597028569.db2.gz	QFHCMWBWFRKOSC-UHFFFAOYSA-N	-2	1	383.187	2.766	20	0		GFADML
O=C([O-])CC[N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000034936902	597131546	/nfs/dbraw/zinc/13/15/46/597131546.db2.gz	ZHCCESIKNSTXIG-UHFFFAOYSA-N	-2	1	377.043	2.509	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2ccccc2CC(=O)[O-])cc1OCC	ZINC000818244799	597315702	/nfs/dbraw/zinc/31/57/02/597315702.db2.gz	SXTQNHLSVXVBME-UHFFFAOYSA-N	-2	1	379.434	2.912	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)N(C)[C@H](C)C(=O)[O-])cc2)c1C	ZINC000263328390	597464871	/nfs/dbraw/zinc/46/48/71/597464871.db2.gz	UCKSZAVSEOXHDR-CQSZACIVSA-N	-2	1	390.461	2.649	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(C(=O)N(C)[C@@H](C)C(=O)[O-])c2)c1	ZINC000263296898	597465832	/nfs/dbraw/zinc/46/58/32/597465832.db2.gz	MORYDUSXAZMJAE-AWEZNQCLSA-N	-2	1	390.461	2.649	20	0		GFADML
CN(CCCC(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1)C(=O)[O-]	ZINC000737431814	599733728	/nfs/dbraw/zinc/73/37/28/599733728.db2.gz	ZKCOPMFSDXBCSZ-UHFFFAOYSA-N	-2	1	391.449	2.816	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1Cl)c1nc(C2CC2)no1	ZINC000736388654	599775242	/nfs/dbraw/zinc/77/52/42/599775242.db2.gz	BMRJIFOERPIFLF-ZDUSSCGKSA-N	-2	1	399.856	2.974	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)NC[C@@H](C)C(=O)[O-])cc2)cc1C	ZINC000655561430	599779361	/nfs/dbraw/zinc/77/93/61/599779361.db2.gz	LEPBXXRQFPALLH-CQSZACIVSA-N	-2	1	390.461	2.555	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)NC[C@@H](C)C(=O)[O-])cc2)c1C	ZINC000262532070	599779506	/nfs/dbraw/zinc/77/95/06/599779506.db2.gz	PGJPKJJARULLOU-CYBMUJFWSA-N	-2	1	390.461	2.555	20	0		GFADML
Cc1cc(NC(=O)c2ccc(S(=O)(=O)[N-]C(C)(C)C)o2)ccc1C(=O)[O-]	ZINC000532256093	599915952	/nfs/dbraw/zinc/91/59/52/599915952.db2.gz	MCFOGIFAGZBSFG-UHFFFAOYSA-N	-2	1	380.422	2.615	20	0		GFADML
CCCN(CC(=O)[O-])C(=O)c1cccc(S(=O)(=O)[N-]c2ccc(F)cc2)c1	ZINC000532250943	600023079	/nfs/dbraw/zinc/02/30/79/600023079.db2.gz	VIPXGYLZXAWLTP-UHFFFAOYSA-N	-2	1	394.424	2.563	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])ccc1Cl	ZINC000736160820	600097144	/nfs/dbraw/zinc/09/71/44/600097144.db2.gz	JNUDHRAXGHCXIN-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
O=C([O-])Nc1cc([N-]S(=O)(=O)c2cccc(C(=O)NC3CC3)c2)ccc1F	ZINC000740013368	600101764	/nfs/dbraw/zinc/10/17/64/600101764.db2.gz	AZHNMIGTMVESIX-UHFFFAOYSA-N	-2	1	393.396	2.609	20	0		GFADML
CC[C@](NC(=O)CCc1c(C)nc(SC)[n-]c1=O)(C(=O)[O-])c1ccccc1	ZINC000736905731	600132461	/nfs/dbraw/zinc/13/24/61/600132461.db2.gz	GDFIFXQMWFBARQ-LJQANCHMSA-N	-2	1	389.477	2.651	20	0		GFADML
O=C([O-])c1sccc1S(=O)(=O)[N-]c1ccc(O[C@@H]2CCCC[C@H]2O)cc1	ZINC000740291321	600245431	/nfs/dbraw/zinc/24/54/31/600245431.db2.gz	ZSZYZAPWDFKZQV-ZIAGYGMSSA-N	-2	1	397.474	2.929	20	0		GFADML
CN(Cc1ccc([N-]S(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1)C(=O)[O-]	ZINC000737486191	600300586	/nfs/dbraw/zinc/30/05/86/600300586.db2.gz	QXEQOIAOTWQKGG-UHFFFAOYSA-N	-2	1	388.401	2.704	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@H](C(=O)[O-])c1ccc(F)cc1	ZINC000737226224	600453743	/nfs/dbraw/zinc/45/37/43/600453743.db2.gz	GDGBVDNMDQXOOC-HNNXBMFYSA-N	-2	1	381.381	2.570	20	0		GFADML
O=C([O-])COc1cccc(CNC(=O)c2cc(Br)ccc2[O-])c1	ZINC000739834126	600575951	/nfs/dbraw/zinc/57/59/51/600575951.db2.gz	GPHNZXPWSGDAJM-UHFFFAOYSA-N	-2	1	380.194	2.548	20	0		GFADML
O=C([O-])c1ccnc([N-]S(=O)(=O)/C=C\c2ccc(Br)cc2)c1	ZINC000740249229	600577256	/nfs/dbraw/zinc/57/72/56/600577256.db2.gz	RVALEYPHEXALJB-VURMDHGXSA-N	-2	1	383.223	2.955	20	0		GFADML
CN(C)C(=O)Sc1cccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)c1	ZINC000737352973	600628862	/nfs/dbraw/zinc/62/88/62/600628862.db2.gz	SLAQMPYCLQMPGQ-UHFFFAOYSA-N	-2	1	394.474	2.888	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)ccc1C	ZINC000736160825	600635550	/nfs/dbraw/zinc/63/55/50/600635550.db2.gz	KBHVQMFKGHNZBJ-UHFFFAOYSA-N	-2	1	381.385	2.983	20	0		GFADML
Cc1cnn(-c2ccc([N-]S(=O)(=O)c3ccsc3C(=O)[O-])cc2F)c1	ZINC000738810250	600636634	/nfs/dbraw/zinc/63/66/34/600636634.db2.gz	WLMIMHSMNNPCMV-UHFFFAOYSA-N	-2	1	381.410	2.880	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)cc1C(=O)[O-]	ZINC000831435485	600688401	/nfs/dbraw/zinc/68/84/01/600688401.db2.gz	ZIKFIWNZBZSMTP-UHFFFAOYSA-N	-2	1	377.418	2.897	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(OC)c(Cl)c2)ccc1C(=O)[O-]	ZINC000831328122	600689436	/nfs/dbraw/zinc/68/94/36/600689436.db2.gz	RJGINSCUNAKGKH-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
Cc1ccc(N2CCOC2=O)cc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000763286450	600691477	/nfs/dbraw/zinc/69/14/77/600691477.db2.gz	GCLOFXHZZUNJTL-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
CCC[C@@H]1[C@H](C)CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829246219	600919179	/nfs/dbraw/zinc/91/91/79/600919179.db2.gz	XLVVEXWLSUJDCV-RDTXWAMCSA-N	-2	1	385.464	2.834	20	0		GFADML
COC(=O)NCc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1	ZINC000735271144	601332278	/nfs/dbraw/zinc/33/22/78/601332278.db2.gz	YGPAROZOJUADOV-UHFFFAOYSA-N	-2	1	392.433	2.658	20	0		GFADML
CN1CCOc2ccc([N-]S(=O)(=O)c3cc(Cl)ccc3C(=O)[O-])cc21	ZINC000830966043	601362836	/nfs/dbraw/zinc/36/28/36/601362836.db2.gz	WKFJSYFPNNSTQG-UHFFFAOYSA-N	-2	1	382.825	2.668	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@H](c2ccccc2)[C@H](C)C(=O)[O-])c(=O)[n-]1	ZINC000832794191	601392131	/nfs/dbraw/zinc/39/21/31/601392131.db2.gz	DXBQZRANMSFZEX-ZBEGNZNMSA-N	-2	1	389.477	2.723	20	0		GFADML
O=C([O-])c1nc(Cl)ccc1S(=O)(=O)[N-]c1ccc(OCC(F)F)cc1	ZINC000833345337	601486570	/nfs/dbraw/zinc/48/65/70/601486570.db2.gz	VKIZGSPOOUWHSL-UHFFFAOYSA-N	-2	1	392.767	2.878	20	0		GFADML
Cc1ccc([C@@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)cc1F	ZINC000832921571	601776362	/nfs/dbraw/zinc/77/63/62/601776362.db2.gz	SDXWJWUZKOFGHW-CYBMUJFWSA-N	-2	1	397.406	2.731	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c(C)c1	ZINC000829804402	601828868	/nfs/dbraw/zinc/82/88/68/601828868.db2.gz	XZCYASYOPDKTCU-UHFFFAOYSA-N	-2	1	396.852	2.897	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(-n3cccn3)c2)cc(F)c1F	ZINC000751147241	601835543	/nfs/dbraw/zinc/83/55/43/601835543.db2.gz	RZSHYSNIOAMKBE-UHFFFAOYSA-N	-2	1	379.344	2.650	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1cccc(OC[C@@H]2CCCO2)c1	ZINC000833293823	601858590	/nfs/dbraw/zinc/85/85/90/601858590.db2.gz	ANUBSWCZIFIJEX-AWEZNQCLSA-N	-2	1	395.408	2.883	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(-n2cncn2)c(Cl)c1	ZINC000833293897	601861775	/nfs/dbraw/zinc/86/17/75/601861775.db2.gz	DAHKCLUIHOOTHI-UHFFFAOYSA-N	-2	1	396.787	2.559	20	0		GFADML
Cc1cnn(-c2ccc([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])cc2F)c1	ZINC000832987643	601863687	/nfs/dbraw/zinc/86/36/87/601863687.db2.gz	VUZYZMHALBDBIT-UHFFFAOYSA-N	-2	1	393.371	2.958	20	0		GFADML
CCc1cc2c(COC(=O)[C@H]3CCCCN3C(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000739541310	602552715	/nfs/dbraw/zinc/55/27/15/602552715.db2.gz	BHBPJHJHSPJWAY-CQSZACIVSA-N	-2	1	375.377	2.637	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(c3nnc4ccccn43)CC2)c([O-])c1	ZINC000740698275	602843626	/nfs/dbraw/zinc/84/36/26/602843626.db2.gz	CGYQHXRFKUPSQX-UHFFFAOYSA-N	-2	1	381.392	2.545	20	0		GFADML
COC(=O)[C@@H](CNC(=O)c1ccc(NC(=O)[O-])cc1[O-])Cc1cccc(C)c1	ZINC000739759201	602860425	/nfs/dbraw/zinc/86/04/25/602860425.db2.gz	OULKDOXIJRHAOV-CQSZACIVSA-N	-2	1	386.404	2.552	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c([O-])c1	ZINC000740699753	602868266	/nfs/dbraw/zinc/86/82/66/602868266.db2.gz	YAMBLLRYWSLRGS-CQSZACIVSA-N	-2	1	389.795	2.671	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)OCC(=O)[N-]C(=O)c2ccccc2)c(Cl)c1	ZINC000740701419	602906015	/nfs/dbraw/zinc/90/60/15/602906015.db2.gz	XOBYGDPSDDJYOL-UHFFFAOYSA-N	-2	1	376.752	2.543	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)cc1	ZINC000823537132	603240877	/nfs/dbraw/zinc/24/08/77/603240877.db2.gz	FCGCZJUNQMSUDY-UHFFFAOYSA-N	-2	1	391.449	2.580	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)cc1	ZINC000828693811	603403212	/nfs/dbraw/zinc/40/32/12/603403212.db2.gz	CBFIVBBPVZQSBR-GFCCVEGCSA-N	-2	1	392.433	2.532	20	0		GFADML
C[C@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1	ZINC000825449460	603492838	/nfs/dbraw/zinc/49/28/38/603492838.db2.gz	QSVDILRSQYYCCQ-NSHDSACASA-N	-2	1	387.417	2.658	20	0		GFADML
Cc1oc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc2c(c1)CCCN2C(=O)[O-]	ZINC000830941955	603624989	/nfs/dbraw/zinc/62/49/89/603624989.db2.gz	AAVKJGMNMAYGHZ-UHFFFAOYSA-N	-2	1	380.378	2.518	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)c([O-])c1	ZINC000832833710	604010018	/nfs/dbraw/zinc/01/00/18/604010018.db2.gz	RANKUHKJWAJNBC-LLVKDONJSA-N	-2	1	376.800	2.539	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])ccc1C	ZINC000823598573	604013229	/nfs/dbraw/zinc/01/32/29/604013229.db2.gz	WYNVXQGSULMKAW-UHFFFAOYSA-N	-2	1	389.433	2.795	20	0		GFADML
COc1ccccc1[C@@H](C[N-]S(=O)(=O)c1cc2ccccc2o1)NC(=O)[O-]	ZINC000829597436	604019964	/nfs/dbraw/zinc/01/99/64/604019964.db2.gz	HLXPXYGZRZOHBQ-CQSZACIVSA-N	-2	1	390.417	2.729	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NC2(C(=O)[O-])CCSCC2)c([O-])c1	ZINC000833443627	604737013	/nfs/dbraw/zinc/73/70/13/604737013.db2.gz	YONCLEIPMPYYOU-UHFFFAOYSA-N	-2	1	396.465	2.819	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(OCC(=O)[O-])c(Cl)c2)cc1F	ZINC000832469003	604806338	/nfs/dbraw/zinc/80/63/38/604806338.db2.gz	ZXAYKPWWPLTJTI-UHFFFAOYSA-N	-2	1	389.788	2.752	20	0		GFADML
CC[C@@](C)([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000828693656	604811274	/nfs/dbraw/zinc/81/12/74/604811274.db2.gz	YYKAMUIBELBQFA-SECBINFHSA-N	-2	1	376.681	2.696	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2F)c(OC)c1C(=O)[O-]	ZINC000833734405	604859208	/nfs/dbraw/zinc/85/92/08/604859208.db2.gz	BYMMAOPTKLSSCD-UHFFFAOYSA-N	-2	1	391.323	2.620	20	0		GFADML
O=C([O-])[C@H](Cc1cnc[nH]1)NC(=O)c1cc(-c2ccccc2)cc(Cl)c1[O-]	ZINC000833768081	605024918	/nfs/dbraw/zinc/02/49/18/605024918.db2.gz	ZAWMFXJLJDDDCA-INIZCTEOSA-N	-2	1	385.807	2.861	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cccc3c2ccnc3C(=O)[O-])cc1F	ZINC000833733496	605150245	/nfs/dbraw/zinc/15/02/45/605150245.db2.gz	RKEQTCLNQLTPGN-UHFFFAOYSA-N	-2	1	376.365	2.882	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)[N-]c2cc(C(=O)[O-])c(F)cc2F)cc1C(=O)[O-]	ZINC000833744372	605168797	/nfs/dbraw/zinc/16/87/97/605168797.db2.gz	CYTMEHMRANFTJD-UHFFFAOYSA-N	-3	1	389.307	2.610	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)Nc2ccc(N(C)C(=O)[O-])cc2)cc1C(=O)[O-]	ZINC000833744677	605169731	/nfs/dbraw/zinc/16/97/31/605169731.db2.gz	MEPZXAYDXQGUJQ-UHFFFAOYSA-N	-2	1	382.369	2.747	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c([O-])c1	ZINC000834258283	605650377	/nfs/dbraw/zinc/65/03/77/605650377.db2.gz	OCVJYGMJMCRZKG-INIZCTEOSA-N	-2	1	384.388	2.830	20	0		GFADML
Cc1cc(C)c(S(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)c(C)c1	ZINC000822195500	606622463	/nfs/dbraw/zinc/62/24/63/606622463.db2.gz	UAJOPJIVMSVTEW-UHFFFAOYSA-N	-2	1	389.485	2.544	20	0		GFADML
COCC[C@@H](C)Sc1nc(-c2ccc(OC)cc2)c(-c2nnn[n-]2)c(=O)[n-]1	ZINC000821685661	606704615	/nfs/dbraw/zinc/70/46/15/606704615.db2.gz	LWRHWLJWKNXGNK-SNVBAGLBSA-N	-2	1	388.453	2.555	20	0		GFADML
CC(C)(C)n1cc(-c2nn[n-]n2)c([N-]S(=O)(=O)C2=Cc3ccccc3CC2)n1	ZINC000819971318	606708767	/nfs/dbraw/zinc/70/87/67/606708767.db2.gz	IHIVYCHEWGNAME-UHFFFAOYSA-N	-2	1	399.480	2.547	20	0		GFADML
CNC(=O)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)ccc1Cl	ZINC000048382758	654705854	/nfs/dbraw/zinc/70/58/54/654705854.db2.gz	QZTXUDVSRJVJNA-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
CC(C)Cc1ccc(S(=O)(=O)[N-]NC(=O)c2ccc(Cl)cc2[O-])cc1	ZINC000055664814	654779907	/nfs/dbraw/zinc/77/99/07/654779907.db2.gz	PLONJSYJZQFOHU-UHFFFAOYSA-N	-2	1	382.869	2.867	20	0		GFADML
Cn1c(Cc2csc(NC(=O)c3c([O-])cc(F)cc3F)n2)n[n-]c1=S	ZINC000066044167	654893582	/nfs/dbraw/zinc/89/35/82/654893582.db2.gz	ZKHXZAUNGKFIMO-UHFFFAOYSA-N	-2	1	383.405	2.761	20	0		GFADML
C[C@@H](CC(F)(F)F)[N-]S(=O)(=O)c1cc(C(=O)[O-])sc1Br	ZINC000235071840	655424459	/nfs/dbraw/zinc/42/44/59/655424459.db2.gz	AJKWOYCUFAONBZ-BYPYZUCNSA-N	-2	1	396.206	2.828	20	0		GFADML
COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)[N-]C(C)(C)CCC(=O)[O-]	ZINC000263541144	655452535	/nfs/dbraw/zinc/45/25/35/655452535.db2.gz	CTVOARQEYXNSNK-UHFFFAOYSA-N	-2	1	398.264	2.702	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cc(F)c(C(=O)[O-])c(F)c2)cc1Cl	ZINC000743261300	655727439	/nfs/dbraw/zinc/72/74/39/655727439.db2.gz	DIPRIARNVNGFEI-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])ccc1F	ZINC000758149386	655924114	/nfs/dbraw/zinc/92/41/14/655924114.db2.gz	VFILJSBBKJJKOM-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc(NC(N)=O)c2)cc(C(=O)[O-])c1Cl	ZINC000759094679	655947384	/nfs/dbraw/zinc/94/73/84/655947384.db2.gz	KXHHAZZMBHJQJB-UHFFFAOYSA-N	-2	1	383.813	2.638	20	0		GFADML
O=C(Nc1nc(Br)ccc1[O-])c1ccc2c(=O)[nH]c(=S)[n-]c2c1	ZINC000771576724	656354136	/nfs/dbraw/zinc/35/41/36/656354136.db2.gz	TVFBAPKLYUEPIR-UHFFFAOYSA-N	-2	1	393.222	2.740	20	0		GFADML
CC[C@@H](C[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)C(=O)[O-]	ZINC000776539405	656754441	/nfs/dbraw/zinc/75/44/41/656754441.db2.gz	PAMRMKSZKQWFFB-LURJTMIESA-N	-2	1	388.642	2.631	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc3c2CCO3)ccc1Br	ZINC000794608093	658577435	/nfs/dbraw/zinc/57/74/35/658577435.db2.gz	FYIUTJIPUBNKHO-UHFFFAOYSA-N	-2	1	398.234	2.883	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000846770457	661565314	/nfs/dbraw/zinc/56/53/14/661565314.db2.gz	BIIUSZMZYYHBTD-HRDYMLBCSA-N	-2	1	381.281	2.802	20	0		GFADML
O=C([O-])[C@@H]1C[C@H]([N-]S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)[C@H]2C[C@H]21	ZINC000926599471	664693540	/nfs/dbraw/zinc/69/35/40/664693540.db2.gz	GAOHNUJNMJHCMB-UVMAFCGOSA-N	-2	1	383.775	2.746	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cccc(Br)c2)ccc1C(=O)[O-]	ZINC000318800319	563443814	/nfs/dbraw/zinc/44/38/14/563443814.db2.gz	MLUTWOCUZCHACH-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
O=C([O-])C[C@@H](CC[N-]S(=O)(=O)c1cccc(Cl)c1F)C(F)(F)F	ZINC000285321969	563514784	/nfs/dbraw/zinc/51/47/84/563514784.db2.gz	ZVNQPMSZTOOSDA-SSDOTTSWSA-N	-2	1	377.743	2.801	20	0		GFADML
C[C@@H]1C[C@@H](NC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])CS1	ZINC000412569298	563661896	/nfs/dbraw/zinc/66/18/96/563661896.db2.gz	HRHVMCARIKEVCU-ZYHUDNBSSA-N	-2	1	398.531	2.878	20	0		GFADML
O=C(N[C@H]1CC[C@@H](F)C1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436744170	563678797	/nfs/dbraw/zinc/67/87/97/563678797.db2.gz	KBOLLTXNGLFZIN-MNOVXSKESA-N	-2	1	384.454	2.875	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(-c3ncon3)cc2)cc1Cl	ZINC000438754566	563709470	/nfs/dbraw/zinc/70/94/70/563709470.db2.gz	PQMAUSAKVUMPOX-UHFFFAOYSA-N	-2	1	379.781	2.889	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000438788047	563710139	/nfs/dbraw/zinc/71/01/39/563710139.db2.gz	UPFNOVRFJKSYNG-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
CC[C@H](C)CONC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000293815452	563824474	/nfs/dbraw/zinc/82/44/74/563824474.db2.gz	UPEVBAUPZBFEGU-NSHDSACASA-N	-2	1	384.479	2.962	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)cc1Cl	ZINC000506629909	564207125	/nfs/dbraw/zinc/20/71/25/564207125.db2.gz	HUFYXCGIEVGTEC-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
C[C@@H](Sc1ccc(NS(=O)(=O)c2csc(C(=O)[O-])c2)cc1)C(=O)[O-]	ZINC000507608797	564234664	/nfs/dbraw/zinc/23/46/64/564234664.db2.gz	XTVLZSYCBZKFJF-MRVPVSSYSA-N	-2	1	387.460	2.812	20	0		GFADML
Cc1n[nH]c(C(F)F)c1[N-]S(=O)(=O)c1ccc(OCC(=O)[O-])c(Cl)c1	ZINC000543661791	564358418	/nfs/dbraw/zinc/35/84/18/564358418.db2.gz	GFIGVOYTGPMHTQ-UHFFFAOYSA-N	-2	1	395.771	2.573	20	0		GFADML
Cc1ncc(C[N-]S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)c(=O)[nH]1	ZINC000544105530	564375347	/nfs/dbraw/zinc/37/53/47/564375347.db2.gz	SSYOXSWGRUXKKH-UHFFFAOYSA-N	-2	1	381.763	2.641	20	0		GFADML
O=C([O-])c1cc(Br)cc([N-]S(=O)(=O)c2ccc3c(c2)COC3)c1	ZINC000512720463	564409982	/nfs/dbraw/zinc/40/99/82/564409982.db2.gz	LMTIZZSSZFOMJO-UHFFFAOYSA-N	-2	1	398.234	2.978	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(F)c1	ZINC000479359358	564437283	/nfs/dbraw/zinc/43/72/83/564437283.db2.gz	CBYXLOHFBPAUJT-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
Cc1ccc(Br)c(C(=O)[O-])c1[N-]S(=O)(=O)c1cccc(N)c1	ZINC000547890703	564516720	/nfs/dbraw/zinc/51/67/20/564516720.db2.gz	YZZBKXALKWYKIN-UHFFFAOYSA-N	-2	1	385.239	2.839	20	0		GFADML
C[C@]1(C(=O)[O-])CCC[C@@H]1[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000548216554	564537647	/nfs/dbraw/zinc/53/76/47/564537647.db2.gz	HNVMEXHJZIXJHX-AAEUAGOBSA-N	-2	1	398.225	2.649	20	0		GFADML
O=C([O-])[C@H](Cc1ccco1)[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F	ZINC000548591453	564565097	/nfs/dbraw/zinc/56/50/97/564565097.db2.gz	FGVNEGSZZUQHMQ-NSHDSACASA-N	-2	1	397.758	2.926	20	0		GFADML
CCc1nnc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C(C)(C)C)s1	ZINC000572005637	564577405	/nfs/dbraw/zinc/57/74/05/564577405.db2.gz	HTNISLQGXBLRNY-UHFFFAOYSA-N	-2	1	389.524	2.636	20	0		GFADML
CC(F)(F)CNC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000572313748	564589882	/nfs/dbraw/zinc/58/98/82/564589882.db2.gz	LRCLWUKJAWDIFI-UHFFFAOYSA-N	-2	1	376.406	2.640	20	0		GFADML
CSc1ccc(S(=O)(=O)[N-]c2cc3c(c(C(=O)[O-])c2)OCCO3)cc1	ZINC000484997607	564604148	/nfs/dbraw/zinc/60/41/48/564604148.db2.gz	SDGUBNGBGAVTEZ-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
O=C([O-])[C@H]1C=C[C@@H]([N-]S(=O)(=O)c2cc(Cl)c(Br)cc2F)C1	ZINC000530354204	564877846	/nfs/dbraw/zinc/87/78/46/564877846.db2.gz	YVGPARGZXIZRAO-NKWVEPMBSA-N	-2	1	398.637	2.549	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]C[C@H](CCC(=O)[O-])C(F)(F)F)c(F)cc1F	ZINC000663293137	565407848	/nfs/dbraw/zinc/40/78/48/565407848.db2.gz	BAICQOWDNXXQMZ-QMMMGPOBSA-N	-2	1	375.315	2.595	20	0		GFADML
O=C([O-])[C@@H](Cc1ccncc1)[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl	ZINC000647928752	565684256	/nfs/dbraw/zinc/68/42/56/565684256.db2.gz	UUFLGSJFIUNBGW-SNVBAGLBSA-N	-2	1	393.223	2.502	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C[S@](C)=O)c1	ZINC000609658310	566047697	/nfs/dbraw/zinc/04/76/97/566047697.db2.gz	IBEHVUNORDUKTO-DEOSSOPVSA-N	-2	1	385.438	2.512	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H]2CCCCCC[C@H]2C(=O)[O-])c(F)c1	ZINC000681580422	566114933	/nfs/dbraw/zinc/11/49/33/566114933.db2.gz	WGMSJEBEXPTYIX-BXUZGUMPSA-N	-2	1	377.409	2.675	20	0		GFADML
C[C@@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Cl)c(Cl)cc1Br	ZINC000656509381	566130240	/nfs/dbraw/zinc/13/02/40/566130240.db2.gz	RUZHULGNGALHIP-YFKPBYRVSA-N	-2	1	391.070	2.897	20	0		GFADML
Cc1[n-]n(-c2ccc(S(=O)(=O)[N-]c3nccs3)cc2)c(=O)c1C1CC1	ZINC000634617610	566161990	/nfs/dbraw/zinc/16/19/90/566161990.db2.gz	UBYNHXDEWMEHEC-CQSZACIVSA-N	-2	1	376.463	2.693	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(C(=O)N(C)CCC(=O)[O-])c2)c1	ZINC000262498472	597005612	/nfs/dbraw/zinc/00/56/12/597005612.db2.gz	HRCPDGJAJZEANC-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)N[C@H](C(=O)[O-])C(C)C)cc1	ZINC000262072238	597024341	/nfs/dbraw/zinc/02/43/41/597024341.db2.gz	CODHEIDGBNUCPW-KRWDZBQOSA-N	-2	1	390.461	2.635	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccccc2CC(=O)[O-])c1Cl	ZINC000820963577	597386046	/nfs/dbraw/zinc/38/60/46/597386046.db2.gz	DBGDPCSQYQUUGT-UHFFFAOYSA-N	-2	1	383.809	2.775	20	0		GFADML
CCC[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736973911	599869500	/nfs/dbraw/zinc/86/95/00/599869500.db2.gz	KWGHXACFMISNOT-KDOFPFPSSA-N	-2	1	385.464	2.881	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(Cn2cccn2)cc1	ZINC000740146724	600098556	/nfs/dbraw/zinc/09/85/56/600098556.db2.gz	URSOGWGZBAEWBG-UHFFFAOYSA-N	-2	1	375.381	2.570	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)c(C)c1	ZINC000737702027	600100958	/nfs/dbraw/zinc/10/09/58/600100958.db2.gz	LEWPIBXNNPULHM-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
O=C([O-])[C@@H]1C[C@H]1C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1	ZINC000485468877	600102200	/nfs/dbraw/zinc/10/22/00/600102200.db2.gz	VILMLPAYAJGVRZ-HUUCEWRRSA-N	-2	1	394.836	2.800	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccc(CNC(=O)[O-])cc1	ZINC000737039297	600308673	/nfs/dbraw/zinc/30/86/73/600308673.db2.gz	XAPPYFCAWGIMGA-UHFFFAOYSA-N	-2	1	391.449	2.858	20	0		GFADML
Cc1ccnc(-c2ccc([N-]S(=O)(=O)c3ccc(O)c(C(=O)[O-])c3)cc2)n1	ZINC000738793570	600613183	/nfs/dbraw/zinc/61/31/83/600613183.db2.gz	ZJHIEJXSYCIURP-UHFFFAOYSA-N	-2	1	385.401	2.657	20	0		GFADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000739767530	600636609	/nfs/dbraw/zinc/63/66/09/600636609.db2.gz	UCLFMOYVWVYTIP-UHFFFAOYSA-N	-3	1	383.809	2.856	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)c1	ZINC000737654512	600638014	/nfs/dbraw/zinc/63/80/14/600638014.db2.gz	SXELHOLJKDGYEY-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2c[nH]c(C(=O)[O-])c2)cc1OCC1CCOCC1	ZINC000265918067	600684999	/nfs/dbraw/zinc/68/49/99/600684999.db2.gz	TXPSIWUSBRLMJZ-UHFFFAOYSA-N	-2	1	394.449	2.628	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)ccc1C(=O)N(C)C	ZINC000466276691	600694036	/nfs/dbraw/zinc/69/40/36/600694036.db2.gz	XCEHDSZFYALDPE-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cccs1)c1nc(-c2cccc(C(=O)[O-])c2)no1	ZINC000827759826	600697590	/nfs/dbraw/zinc/69/75/90/600697590.db2.gz	AIOZCDKQAGKNIE-VIFPVBQESA-N	-2	1	379.419	2.536	20	0		GFADML
CN(C)C(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737362391	600888253	/nfs/dbraw/zinc/88/82/53/600888253.db2.gz	VRDDNBIMRXUUST-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
COc1ccc(-c2ncc(C(=O)[N-]c3nnc(CCC(=O)[O-])s3)s2)cc1	ZINC000832133814	600890531	/nfs/dbraw/zinc/89/05/31/600890531.db2.gz	AJJXUYLBMOVNRE-UHFFFAOYSA-N	-2	1	390.446	2.940	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)cc1	ZINC000610111217	600899292	/nfs/dbraw/zinc/89/92/92/600899292.db2.gz	GDLNRROIBCBRNA-UHFFFAOYSA-N	-2	1	391.445	2.565	20	0		GFADML
O=C([O-])CSCCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000739850609	600901663	/nfs/dbraw/zinc/90/16/63/600901663.db2.gz	WUPFUMICQSSAJJ-UHFFFAOYSA-N	-2	1	394.474	2.634	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)[C@H]1c1ccccc1	ZINC000828394944	600936892	/nfs/dbraw/zinc/93/68/92/600936892.db2.gz	URKPEEDVGAHENC-LHSJRXKWSA-N	-2	1	391.427	2.626	20	0		GFADML
CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(C(=O)NCCC(=O)[O-])cc2)c1	ZINC000460414102	601045568	/nfs/dbraw/zinc/04/55/68/601045568.db2.gz	WGBOXJYQAFKFOP-UHFFFAOYSA-N	-2	1	390.461	2.815	20	0		GFADML
CC(C)c1nc(C2([N-]S(=O)(=O)c3cc(C(=O)[O-])cs3)CCCC2)no1	ZINC000576870058	601227613	/nfs/dbraw/zinc/22/76/13/601227613.db2.gz	KHVOKAFOVIZTBT-UHFFFAOYSA-N	-2	1	385.467	2.701	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000432208195	601234701	/nfs/dbraw/zinc/23/47/01/601234701.db2.gz	NDKHGAIOFJJDLE-UHFFFAOYSA-N	-2	1	379.434	2.909	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])c1	ZINC000831705628	601234724	/nfs/dbraw/zinc/23/47/24/601234724.db2.gz	XQTIAJINAZEFKX-UHFFFAOYSA-N	-2	1	379.434	2.909	20	0		GFADML
O=C([O-])CCC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(NC(=O)[O-])c2)cc1	ZINC000833222895	601250316	/nfs/dbraw/zinc/25/03/16/601250316.db2.gz	GJFJEHJYGGZNLO-UHFFFAOYSA-N	-3	1	392.389	2.625	20	0		GFADML
CC(C)(CCC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000261718304	601258020	/nfs/dbraw/zinc/25/80/20/601258020.db2.gz	QTKPQBDKQSBAMR-UHFFFAOYSA-N	-2	1	386.214	2.649	20	0		GFADML
CCOC(=O)/C=C\c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000737864259	601320243	/nfs/dbraw/zinc/32/02/43/601320243.db2.gz	OMRHQSOTNXTYQI-YHYXMXQVSA-N	-2	1	393.392	2.901	20	0		GFADML
CCn1cnnc1-c1cccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000032096059	601321523	/nfs/dbraw/zinc/32/15/23/601321523.db2.gz	OXIDUROMYAVXDZ-DHZHZOJOSA-N	-2	1	398.444	2.864	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3cc(C(=O)[O-])cc(C)c3C)c2)n[nH]1	ZINC000613176276	601326028	/nfs/dbraw/zinc/32/60/28/601326028.db2.gz	MJSWWELAINUXFY-UHFFFAOYSA-N	-2	1	386.433	2.896	20	0		GFADML
CC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1	ZINC000068175823	601327370	/nfs/dbraw/zinc/32/73/70/601327370.db2.gz	MHBNGZKZEYFKKX-UHFFFAOYSA-N	-2	1	376.434	2.785	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1F)c1nc(C2CCCCC2)no1	ZINC000827746944	601385054	/nfs/dbraw/zinc/38/50/54/601385054.db2.gz	IDAGMDLFGPEFQQ-JTQLQIEISA-N	-2	1	397.428	2.994	20	0		GFADML
CCc1oc(C(=O)[O-])cc1COC(=O)CCc1c(C)nc2cc(=O)[n-]n2c1C	ZINC000830384456	601464090	/nfs/dbraw/zinc/46/40/90/601464090.db2.gz	RXAWWGZSBLAPDQ-UHFFFAOYSA-N	-2	1	387.392	2.581	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)cc1Cl	ZINC000825907774	601474814	/nfs/dbraw/zinc/47/48/14/601474814.db2.gz	CIOILIXOBHQHKZ-UHFFFAOYSA-N	-2	1	397.840	2.867	20	0		GFADML
O=C([O-])CCOc1ccc(S(=O)(=O)[N-]c2cc(-c3ccccc3)n[nH]2)cc1	ZINC000833238920	601605894	/nfs/dbraw/zinc/60/58/94/601605894.db2.gz	KGBQALQTSYATGX-UHFFFAOYSA-N	-2	1	387.417	2.731	20	0		GFADML
CC[C@H](NC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1)C(=O)[O-]	ZINC000828976430	601749074	/nfs/dbraw/zinc/74/90/74/601749074.db2.gz	PWAJKWFNJPVCKC-HNNXBMFYSA-N	-2	1	396.852	2.734	20	0		GFADML
CC[C@H](NC(=O)c1cc(S(=O)(=O)[N-]c2ccc(F)cc2)ccc1C)C(=O)[O-]	ZINC000485869689	601750443	/nfs/dbraw/zinc/75/04/43/601750443.db2.gz	MEBGIJKWZMMYFQ-INIZCTEOSA-N	-2	1	394.424	2.528	20	0		GFADML
Cc1cc(Br)cc(C)c1S(=O)(=O)[N-]c1cc(C(=O)[O-])n(C)c1	ZINC000832858510	601784871	/nfs/dbraw/zinc/78/48/71/601784871.db2.gz	KOYYLTZWJJCSQR-UHFFFAOYSA-N	-2	1	387.255	2.903	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C)c2)ccc1Cl	ZINC000757479047	601829075	/nfs/dbraw/zinc/82/90/75/601829075.db2.gz	ZARJTBWFOONFSX-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)CCCC(=O)N3)cc(F)c1F	ZINC000370267351	601840212	/nfs/dbraw/zinc/84/02/12/601840212.db2.gz	DJQRIIZIFWLBKB-UHFFFAOYSA-N	-2	1	396.371	2.739	20	0		GFADML
O=C([O-])c1nscc1S(=O)(=O)[N-]c1cc(Br)ccc1F	ZINC000833344968	601841682	/nfs/dbraw/zinc/84/16/82/601841682.db2.gz	HICDGNZPKULUTO-UHFFFAOYSA-N	-2	1	381.204	2.544	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])ccc2o1	ZINC000831831189	601847826	/nfs/dbraw/zinc/84/78/26/601847826.db2.gz	GKBHLIAHZSCCQE-UHFFFAOYSA-N	-2	1	380.353	2.612	20	0		GFADML
CC(C)C(=O)Nc1cccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])c1	ZINC000826669621	601857332	/nfs/dbraw/zinc/85/73/32/601857332.db2.gz	PEINDMLFTRAGGY-UHFFFAOYSA-N	-2	1	380.397	2.919	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1C(=O)NC(C)C	ZINC000832950733	601861575	/nfs/dbraw/zinc/86/15/75/601861575.db2.gz	YECKSZDRVRGLRN-UHFFFAOYSA-N	-2	1	394.424	2.771	20	0		GFADML
Cc1coc(-c2cc([N-]S(=O)(=O)c3cc(C(=O)[O-])n(C)c3)ccc2C)n1	ZINC000363855779	601989150	/nfs/dbraw/zinc/98/91/50/601989150.db2.gz	QYQKHIBNDNKQLP-UHFFFAOYSA-N	-2	1	375.406	2.796	20	0		GFADML
Cc1nc(C)n(-c2ccccc2[N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)n1	ZINC000477458680	601989228	/nfs/dbraw/zinc/98/92/28/601989228.db2.gz	WHLRWJBUPCRVAO-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2cc(CC3CCCCC3)n[nH]2)cc1	ZINC000833267358	602103723	/nfs/dbraw/zinc/10/37/23/602103723.db2.gz	YNGAFPBVYKCEGQ-UHFFFAOYSA-N	-2	1	377.466	2.960	20	0		GFADML
Cc1cc(Oc2ccc([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)cc2)n[nH]1	ZINC000469153712	602301869	/nfs/dbraw/zinc/30/18/69/602301869.db2.gz	YBFJJIGMOPIADI-UHFFFAOYSA-N	-2	1	387.417	2.938	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)Nc2ccc(NC(=O)[O-])cc2)o1	ZINC000738703985	602502662	/nfs/dbraw/zinc/50/26/62/602502662.db2.gz	JTPTVTIICUBVDV-UHFFFAOYSA-N	-2	1	381.410	2.699	20	0		GFADML
CCN(Cc1cccc([N-]S(=O)(=O)c2ccc3c(c2)OCCO3)c1)C(=O)[O-]	ZINC000739445748	602654380	/nfs/dbraw/zinc/65/43/80/602654380.db2.gz	FXJYUJRJRQGZQY-UHFFFAOYSA-N	-2	1	392.433	2.759	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCN(C/C=C\c3ccccc3)CC2)c([O-])c1	ZINC000740700230	602842675	/nfs/dbraw/zinc/84/26/75/602842675.db2.gz	TYKSKFCZHIFBSL-DAXSKMNVSA-N	-2	1	381.432	2.953	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCC[C@H](NC(=O)[O-])C2)c([O-])c1	ZINC000737583559	602852631	/nfs/dbraw/zinc/85/26/31/602852631.db2.gz	FTVLSVFXNJSGIR-LBPRGKRZSA-N	-2	1	379.413	2.611	20	0		GFADML
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)cc1	ZINC000827350725	603400277	/nfs/dbraw/zinc/40/02/77/603400277.db2.gz	YIVKLLLYBKJDEA-GFCCVEGCSA-N	-2	1	392.433	2.993	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC([C@H]2CCCN2C(=O)[O-])CC1	ZINC000830704752	603481309	/nfs/dbraw/zinc/48/13/09/603481309.db2.gz	RASQLITXQVYEAJ-CQSZACIVSA-N	-2	1	390.484	2.783	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(SCCC(=O)[O-])c2)c1	ZINC000833716649	604538924	/nfs/dbraw/zinc/53/89/24/604538924.db2.gz	PBYZCMONIWIEPV-UHFFFAOYSA-N	-2	1	395.458	2.841	20	0		GFADML
CC(C)OC[C@@H](C(=O)[O-])N(C)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-]	ZINC000833504275	604732458	/nfs/dbraw/zinc/73/24/58/604732458.db2.gz	AXHBEBBCKNRFFB-AWEZNQCLSA-N	-2	1	396.440	2.689	20	0		GFADML
CCC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C(=O)OC)c(C(=O)[O-])c2)c1	ZINC000828580493	604790915	/nfs/dbraw/zinc/79/09/15/604790915.db2.gz	KPXUYBZTZVVYRB-UHFFFAOYSA-N	-2	1	391.401	2.565	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ncc(Br)cc1F	ZINC000833747961	604884882	/nfs/dbraw/zinc/88/48/82/604884882.db2.gz	PTWHPOQLGMCNMY-UHFFFAOYSA-N	-2	1	389.202	2.791	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])c(Cl)c1)c1nc(C2CC2)no1	ZINC000563073557	605001745	/nfs/dbraw/zinc/00/17/45/605001745.db2.gz	WQFODAULMDMSSZ-CYBMUJFWSA-N	-2	1	399.856	2.974	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(NC(=O)[O-])c(F)c1	ZINC000833670119	605264823	/nfs/dbraw/zinc/26/48/23/605264823.db2.gz	KLJHEEFPTVTIQH-UHFFFAOYSA-N	-3	1	382.369	2.977	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cccc(C(=O)OCCCC(=O)[O-])c2)cc1	ZINC000833733284	605277336	/nfs/dbraw/zinc/27/73/36/605277336.db2.gz	LFQOYUUPMRHIRE-UHFFFAOYSA-N	-2	1	393.417	2.518	20	0		GFADML
O=C([O-])N[C@@H]1CCC[C@H]2CN(C(=O)c3cc(Br)ccc3[O-])C[C@@H]21	ZINC000834184369	605495033	/nfs/dbraw/zinc/49/50/33/605495033.db2.gz	VWYKIOKVJBHRSQ-TVYUQYBPSA-N	-2	1	383.242	2.663	20	0		GFADML
O=C([O-])N(CC(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1)C1CC1	ZINC000834003838	605981091	/nfs/dbraw/zinc/98/10/91/605981091.db2.gz	QMDAISZLBUTYKN-UHFFFAOYSA-N	-2	1	389.433	2.568	20	0		GFADML
NC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)c(Cl)c(C(=O)[O-])c2)c1	ZINC000058488578	654818430	/nfs/dbraw/zinc/81/84/30/654818430.db2.gz	YZULJMNBDABHOB-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
CSC[C@@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000265574582	655486216	/nfs/dbraw/zinc/48/62/16/655486216.db2.gz	WPAVFQNMEGGCCB-SNVBAGLBSA-N	-2	1	386.520	2.736	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(F)c(C(=O)[O-])c2)c1Cl	ZINC000753771352	655858252	/nfs/dbraw/zinc/85/82/52/655858252.db2.gz	OCICEWNMQGNYFO-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2C)ccc1Cl	ZINC000757475469	655911794	/nfs/dbraw/zinc/91/17/94/655911794.db2.gz	YAVQLJCMVBKVRZ-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COc1cc(F)c([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2F)cc1F	ZINC000758452814	655933283	/nfs/dbraw/zinc/93/32/83/655933283.db2.gz	NAYYGZIRFKQLCF-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
C[S@](=O)Cc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1	ZINC000762452902	656042505	/nfs/dbraw/zinc/04/25/05/656042505.db2.gz	INHHGWWZPFHVCX-QHCPKHFHSA-N	-2	1	387.866	2.718	20	0		GFADML
COc1ccccc1[C@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)C(=O)[O-]	ZINC000776520681	656750582	/nfs/dbraw/zinc/75/05/82/656750582.db2.gz	PBFVGWKQCJKNBC-NSHDSACASA-N	-2	1	391.232	2.501	20	0		GFADML
CC[C@H](C)C[C@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000776616673	656768186	/nfs/dbraw/zinc/76/81/86/656768186.db2.gz	VOKSOOWSJKXTNQ-CBAPKCEASA-N	-2	1	399.694	2.665	20	0		GFADML
O=C([O-])CC[C@H](C[N-]S(=O)(=O)c1ccc(Cl)nc1Cl)C(F)(F)F	ZINC000853071605	661880943	/nfs/dbraw/zinc/88/09/43/661880943.db2.gz	OGRWTMFLSGUGBY-ZCFIWIBFSA-N	-2	1	395.186	2.710	20	0		GFADML
Cc1cc(Br)c([O-])c(NC(=O)Cc2cc(=O)n(CC(C)C)[n-]2)c1	ZINC000935271475	664949700	/nfs/dbraw/zinc/94/97/00/664949700.db2.gz	SLAXQCBIOFFNAZ-UHFFFAOYSA-N	-2	1	382.258	2.790	20	0		GFADML
CNC(=O)c1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)ccc1Cl	ZINC000327650404	563459599	/nfs/dbraw/zinc/45/95/99/563459599.db2.gz	VPQNDQRVOHSUFI-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
O=C(Nc1cccc(-c2n[nH]c(=O)[n-]2)c1)c1cc(Br)ccc1[O-]	ZINC000436686332	563676948	/nfs/dbraw/zinc/67/69/48/563676948.db2.gz	DWHFENYWWHUJQQ-UHFFFAOYSA-N	-2	1	375.182	2.898	20	0		GFADML
C[C@H]1Cc2cc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(O)c3)cc(Cl)c2O1	ZINC000436773438	563679369	/nfs/dbraw/zinc/67/93/69/563679369.db2.gz	RNLOAEYHYJTVEL-QMMMGPOBSA-N	-2	1	383.809	2.868	20	0		GFADML
C[S@@](=O)Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000438772156	563710345	/nfs/dbraw/zinc/71/03/45/563710345.db2.gz	DKRYPMFOLQZEJI-HSZRJFAPSA-N	-2	1	387.866	2.718	20	0		GFADML
O=C([O-])c1cc(Br)c(S(=O)(=O)[N-]CC2CC(F)(F)C2)s1	ZINC000291984228	563767805	/nfs/dbraw/zinc/76/78/05/563767805.db2.gz	VNHJPVZSPYCHSF-UHFFFAOYSA-N	-2	1	390.227	2.532	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccc(S(=O)(=O)N[C@]2(C)CC=CCC2)c(F)c1	ZINC000416560810	563848566	/nfs/dbraw/zinc/84/85/66/563848566.db2.gz	RLHIBIBMJYDJJN-MRXNPFEDSA-N	-2	1	390.502	2.755	20	0		GFADML
O=C([O-])Cc1ccc([N-]S(=O)(=O)c2ccc(OC(F)F)c(F)c2)cc1	ZINC000447777099	563885842	/nfs/dbraw/zinc/88/58/42/563885842.db2.gz	DVQVZUYOVQKVCA-UHFFFAOYSA-N	-2	1	375.324	2.855	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(Cl)c(C)c(C(=O)[O-])c2)ccc1C(N)=O	ZINC000479247591	564432958	/nfs/dbraw/zinc/43/29/58/564432958.db2.gz	FCQIHJFVVNHEGJ-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)s1	ZINC000547889974	564516698	/nfs/dbraw/zinc/51/66/98/564516698.db2.gz	MAORWVIPTMQMRD-UHFFFAOYSA-N	-2	1	375.811	2.687	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(F)cc(F)cc1F)c1cccc(Cl)c1	ZINC000547908536	564519978	/nfs/dbraw/zinc/51/99/78/564519978.db2.gz	AGJHMOBDTPVOKN-GFCCVEGCSA-N	-2	1	379.743	2.862	20	0		GFADML
CCc1ccc([C@@H](COC)[N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])o1	ZINC000570959547	564529762	/nfs/dbraw/zinc/52/97/62/564529762.db2.gz	HSKABPXDCALQIV-CYBMUJFWSA-N	-2	1	387.841	2.860	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)[C@H](C)C(=O)[O-]	ZINC000571997153	564576288	/nfs/dbraw/zinc/57/62/88/564576288.db2.gz	UDFGQLLRMMIWCX-WDSKDSINSA-N	-2	1	388.642	2.629	20	0		GFADML
C[C@@H]1CC[C@](C[N-]S(=O)(=O)c2ccc(Br)o2)(CC(=O)[O-])C1	ZINC000548547315	564558556	/nfs/dbraw/zinc/55/85/56/564558556.db2.gz	CISIXVHYHQCYHS-NOZJJQNGSA-N	-2	1	380.260	2.602	20	0		GFADML
C[C@@H](C[N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl)C(=O)[O-]	ZINC000573149950	564625114	/nfs/dbraw/zinc/62/51/14/564625114.db2.gz	PTPHTTJRXGIILD-YFKPBYRVSA-N	-2	1	391.070	2.755	20	0		GFADML
CC(C)(C)OC[C@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Cl)C(=O)[O-]	ZINC000573569424	564644396	/nfs/dbraw/zinc/64/43/96/564644396.db2.gz	WLCGQYCDHPERFK-JTQLQIEISA-N	-2	1	388.244	2.679	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)c(C)cc1C	ZINC000527065114	564729238	/nfs/dbraw/zinc/72/92/38/564729238.db2.gz	DTTORCXJRYPLIA-UHFFFAOYSA-N	-2	1	383.447	2.959	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)C(F)F	ZINC000554785856	564773889	/nfs/dbraw/zinc/77/38/89/564773889.db2.gz	MSNQPEKJFDFLTR-LURJTMIESA-N	-2	1	395.733	2.993	20	0		GFADML
CCC[C@@H](CCCC[N-]S(=O)(=O)c1ccc(Br)o1)C(=O)[O-]	ZINC000555955232	564809622	/nfs/dbraw/zinc/80/96/22/564809622.db2.gz	XYEKGMQCFZZEQG-JTQLQIEISA-N	-2	1	382.276	2.992	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)ccc1C	ZINC000467082883	564955000	/nfs/dbraw/zinc/95/50/00/564955000.db2.gz	RSGBJSNFRGNHDN-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
C[C@H]1SCC[C@@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000649175454	565751416	/nfs/dbraw/zinc/75/14/16/565751416.db2.gz	UKQGUMYHMMTNIH-MFKMUULPSA-N	-2	1	398.531	2.878	20	0		GFADML
COc1ccc(-c2nc(SCc3ncc(C)o3)[n-]c(=O)c2-c2nnn[n-]2)cc1	ZINC000737057305	599161877	/nfs/dbraw/zinc/16/18/77/599161877.db2.gz	QMYAFZWADOOAJK-UHFFFAOYSA-N	-2	1	397.420	2.627	20	0		GFADML
COc1ccc(-c2nc(SCc3ncc(C)o3)[n-]c(=O)c2-c2nn[n-]n2)cc1	ZINC000737057305	599161882	/nfs/dbraw/zinc/16/18/82/599161882.db2.gz	QMYAFZWADOOAJK-UHFFFAOYSA-N	-2	1	397.420	2.627	20	0		GFADML
O=C([O-])c1ccccc1S(=O)(=O)[N-]c1ccc(-c2n[nH]c(C3CC3)n2)cc1	ZINC000740243346	599769053	/nfs/dbraw/zinc/76/90/53/599769053.db2.gz	ZRJRGCSYGRUSJR-UHFFFAOYSA-N	-2	1	384.417	2.848	20	0		GFADML
Cc1nc(COc2ccc([N-]S(=O)(=O)c3ccsc3C(=O)[O-])cc2)no1	ZINC000738857322	599839528	/nfs/dbraw/zinc/83/95/28/599839528.db2.gz	NCMWWSLMWXNZMU-UHFFFAOYSA-N	-2	1	395.418	2.518	20	0		GFADML
COCCOCc1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)c1	ZINC000675628103	599906210	/nfs/dbraw/zinc/90/62/10/599906210.db2.gz	HNVPYDYPVYTLED-UHFFFAOYSA-N	-2	1	379.434	2.657	20	0		GFADML
CCN(CC)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C)c2)cc1	ZINC000264125270	599924921	/nfs/dbraw/zinc/92/49/21/599924921.db2.gz	ZQYFSIZFVCDFBM-UHFFFAOYSA-N	-2	1	390.461	2.976	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(N2CCCCC2)nc1	ZINC000738276913	599966363	/nfs/dbraw/zinc/96/63/63/599966363.db2.gz	LPVSMFZWDFCNFW-UHFFFAOYSA-N	-2	1	375.450	2.879	20	0		GFADML
CCOc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)OC)c2)ccc1C	ZINC000737192593	600100202	/nfs/dbraw/zinc/10/02/02/600100202.db2.gz	VYXBNCVUAHKBTA-UHFFFAOYSA-N	-2	1	393.417	2.679	20	0		GFADML
CN(C)c1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(OCC(=O)[O-])cc1	ZINC000327020120	600104714	/nfs/dbraw/zinc/10/47/14/600104714.db2.gz	SJTPIBJJZZDZGY-UHFFFAOYSA-N	-2	1	384.841	2.670	20	0		GFADML
CC[C@@](NC(=O)CCc1c(C)nc(SC)[n-]c1=O)(C(=O)[O-])c1ccccc1	ZINC000736905729	600132665	/nfs/dbraw/zinc/13/26/65/600132665.db2.gz	GDFIFXQMWFBARQ-IBGZPJMESA-N	-2	1	389.477	2.651	20	0		GFADML
Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)o1	ZINC000738584082	600214265	/nfs/dbraw/zinc/21/42/65/600214265.db2.gz	SNOMCSMVARKXFD-KRWDZBQOSA-N	-2	1	395.415	2.671	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(OCCCC(=O)[O-])cc1	ZINC000738993468	600488230	/nfs/dbraw/zinc/48/82/30/600488230.db2.gz	VBMHRWHBLSNNIF-UHFFFAOYSA-N	-3	1	399.446	2.799	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])c1	ZINC000737653106	600637799	/nfs/dbraw/zinc/63/77/99/600637799.db2.gz	GGMCZDUCQNXHBZ-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC(=O)NCCc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000736153209	600637952	/nfs/dbraw/zinc/63/79/52/600637952.db2.gz	ZNIQKHQCDOWTLA-UHFFFAOYSA-N	-2	1	396.852	2.518	20	0		GFADML
CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2cccc(OCC(=O)[O-])c2)cc1	ZINC000826669414	600674656	/nfs/dbraw/zinc/67/46/56/600674656.db2.gz	HSAJLJQUPIJPMC-UHFFFAOYSA-N	-2	1	377.418	2.790	20	0		GFADML
CN(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000830518488	600678192	/nfs/dbraw/zinc/67/81/92/600678192.db2.gz	DOLPRDLHSSNFOT-UHFFFAOYSA-N	-3	1	384.797	2.953	20	0		GFADML
Cc1ccc(N2CCOC2=O)cc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000795327523	600691304	/nfs/dbraw/zinc/69/13/04/600691304.db2.gz	ZMALRKCEKRTIDH-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
Cc1ccc(C(=O)NC2CC2)cc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)[O-])c1	ZINC000055613021	600811434	/nfs/dbraw/zinc/81/14/34/600811434.db2.gz	WPDGCVCZHLFTRQ-UHFFFAOYSA-N	-2	1	388.445	2.695	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)ccc1C	ZINC000831348419	600816969	/nfs/dbraw/zinc/81/69/69/600816969.db2.gz	KXFZMZOFBBVQAY-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
CNC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737543281	600888329	/nfs/dbraw/zinc/88/83/29/600888329.db2.gz	PGYOQYVOIHRRTI-UHFFFAOYSA-N	-2	1	383.813	2.590	20	0		GFADML
CNC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1C	ZINC000737551268	600889506	/nfs/dbraw/zinc/88/95/06/600889506.db2.gz	FKCUJZCCBHIUJJ-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)N(C)C)c(C)c2)ccc1C(=O)[O-]	ZINC000507987831	600894183	/nfs/dbraw/zinc/89/41/83/600894183.db2.gz	WATCHKQGLVANDN-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)c(F)c2)ccc1C(=O)[O-]	ZINC000506602991	600894190	/nfs/dbraw/zinc/89/41/90/600894190.db2.gz	SXEOJSCFVDNNQX-UHFFFAOYSA-N	-2	1	392.408	2.760	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2c(O)cccc2F)ccc1Br	ZINC000740087709	601117208	/nfs/dbraw/zinc/11/72/08/601117208.db2.gz	LIBGTYFYVPSQJQ-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCc2[nH]c3ccc(C(=O)[O-])cc3c2C1	ZINC000832994676	601275196	/nfs/dbraw/zinc/27/51/96/601275196.db2.gz	WGOWLEBDXNVRQA-UHFFFAOYSA-N	-2	1	394.431	2.992	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)ccc1NC(C)=O	ZINC000614822150	601323468	/nfs/dbraw/zinc/32/34/68/601323468.db2.gz	VDBNRCZFYHZVNI-UHFFFAOYSA-N	-2	1	392.433	2.769	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1c(C)cc(C)cc1C(=O)[O-]	ZINC000110276720	601328615	/nfs/dbraw/zinc/32/86/15/601328615.db2.gz	MUWUCAUKGBQBRX-UHFFFAOYSA-N	-2	1	379.390	2.509	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cc(F)c(C(=O)[O-])c(F)c2)c1C	ZINC000742231708	601333464	/nfs/dbraw/zinc/33/34/64/601333464.db2.gz	DOUUTFDOWJLCPC-UHFFFAOYSA-N	-3	1	385.344	2.779	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])s1)c1nc(C2CCCCC2)no1	ZINC000827755237	601384870	/nfs/dbraw/zinc/38/48/70/601384870.db2.gz	OMAPNGGIFAECNM-SECBINFHSA-N	-2	1	385.467	2.917	20	0		GFADML
C/C(=C/COC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1)C(=O)[O-]	ZINC000825780670	601406562	/nfs/dbraw/zinc/40/65/62/601406562.db2.gz	GPFCVJXODUASGX-QBFSEMIESA-N	-2	1	375.402	2.675	20	0		GFADML
CCc1oc(C(=O)[O-])cc1COC(=O)c1ccccc1[N-]S(=O)(=O)CC	ZINC000830390458	601464387	/nfs/dbraw/zinc/46/43/87/601464387.db2.gz	HVRMDPYXHGYFIR-UHFFFAOYSA-N	-2	1	381.406	2.659	20	0		GFADML
CN(C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CCC(C)(C)CC1	ZINC000830523641	601763021	/nfs/dbraw/zinc/76/30/21/601763021.db2.gz	NZKOIFGFSIHSDO-UHFFFAOYSA-N	-2	1	385.464	2.834	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1C	ZINC000728510204	601828406	/nfs/dbraw/zinc/82/84/06/601828406.db2.gz	FJIUZUXOOHGIDH-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)cc2)cc(F)c1F	ZINC000751145233	601832002	/nfs/dbraw/zinc/83/20/02/601832002.db2.gz	CZQXEYKNINNBGR-UHFFFAOYSA-N	-2	1	396.371	2.591	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c(C)c1	ZINC000829803611	601836509	/nfs/dbraw/zinc/83/65/09/601836509.db2.gz	FHWKJGUZJGUHHY-UHFFFAOYSA-N	-2	1	398.387	2.522	20	0		GFADML
CCN(CC)C(=O)c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000829659284	601855948	/nfs/dbraw/zinc/85/59/48/601855948.db2.gz	YHSCSBCEGQMSLR-UHFFFAOYSA-N	-2	1	394.424	2.807	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1cccc(F)c1C(=O)[O-]	ZINC000832774185	601856937	/nfs/dbraw/zinc/85/69/37/601856937.db2.gz	DUTDGASCLRRBEP-UHFFFAOYSA-N	-2	1	385.394	2.745	20	0		GFADML
CC1(C)CN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c2ccccc21	ZINC000828074790	602059787	/nfs/dbraw/zinc/05/97/87/602059787.db2.gz	RAOAGCFZYKIZAY-UHFFFAOYSA-N	-2	1	391.427	2.731	20	0		GFADML
CSc1nc(C)c(CCC(=O)Nc2cccc(CNC(=O)[O-])c2)c(=O)[n-]1	ZINC000740020333	602204177	/nfs/dbraw/zinc/20/41/77/602204177.db2.gz	KUJIMANWTLZCDE-UHFFFAOYSA-N	-2	1	376.438	2.551	20	0		GFADML
CSc1nc(C)c(CCC(=O)Nc2ccc3c(c2)CCN3C(=O)[O-])c(=O)[n-]1	ZINC000740019745	602240114	/nfs/dbraw/zinc/24/01/14/602240114.db2.gz	FYSHNSPOWPPBBP-UHFFFAOYSA-N	-2	1	388.449	2.824	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)Nc1ccc2c(c1)CCN2C(=O)[O-]	ZINC000740229471	602254041	/nfs/dbraw/zinc/25/40/41/602254041.db2.gz	KLSXUENHRCQSEM-UHFFFAOYSA-N	-2	1	395.419	2.664	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1cc(CCc2ccccc2)n[nH]1	ZINC000833294551	602306625	/nfs/dbraw/zinc/30/66/25/602306625.db2.gz	JMMBZAVXNYCXRM-UHFFFAOYSA-N	-2	1	389.408	2.833	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(OC)c(NC(=O)[O-])c2)c1C	ZINC000739788046	602673422	/nfs/dbraw/zinc/67/34/22/602673422.db2.gz	INILHOJUCHZBFS-UHFFFAOYSA-N	-2	1	394.405	2.681	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(NC(=O)c3ccsc3)CC2)c([O-])c1	ZINC000740700499	602854459	/nfs/dbraw/zinc/85/44/59/602854459.db2.gz	ZDAHZTKNAOPPSW-UHFFFAOYSA-N	-2	1	389.433	2.578	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NCCN(C(=O)[O-])C2CC2)c([O-])c1	ZINC000738723940	602857855	/nfs/dbraw/zinc/85/78/55/602857855.db2.gz	UBTLAKCLUIDIAB-UHFFFAOYSA-N	-2	1	379.413	2.611	20	0		GFADML
Cc1csc(N2CCN(C(=O)c3ccc(NC(=O)[O-])cc3[O-])C[C@H]2C)n1	ZINC000740210398	602867121	/nfs/dbraw/zinc/86/71/21/602867121.db2.gz	VPKDKWSPNZTEBO-LLVKDONJSA-N	-2	1	376.438	2.598	20	0		GFADML
O=C([O-])N1CCCC[C@H](NC(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)C1	ZINC000740729157	602972258	/nfs/dbraw/zinc/97/22/58/602972258.db2.gz	LUYYNSHNCOTWBW-INIZCTEOSA-N	-2	1	389.452	2.529	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)c1	ZINC000828799794	603401362	/nfs/dbraw/zinc/40/13/62/603401362.db2.gz	ROQVVYDKMBXVGD-NSHDSACASA-N	-2	1	378.406	2.603	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC[C@H]([C@H]2CCCN2C(=O)[O-])C1	ZINC000830709543	603481316	/nfs/dbraw/zinc/48/13/16/603481316.db2.gz	LPWXODXPKNYQNV-UONOGXRCSA-N	-2	1	376.457	2.609	20	0		GFADML
CCOC(=O)c1sc([C@H](C)NC(=O)c2ccc(NC(=O)[O-])cc2[O-])nc1C	ZINC000827355341	603804960	/nfs/dbraw/zinc/80/49/60/603804960.db2.gz	HQTBXDUPVAEMCR-VIFPVBQESA-N	-2	1	393.421	2.915	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])cc2)c2cccnc12	ZINC000832419702	604622166	/nfs/dbraw/zinc/62/21/66/604622166.db2.gz	ZPHLAHJTEZFLFR-UHFFFAOYSA-N	-2	1	388.401	2.508	20	0		GFADML
CN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])[C@H]1CCN(C(=O)[O-])C1	ZINC000827938256	604921279	/nfs/dbraw/zinc/92/12/79/604921279.db2.gz	HTYJDNXBNVOEBZ-LBPRGKRZSA-N	-2	1	379.413	2.564	20	0		GFADML
CCC[C@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2C)cc1)C(=O)[O-]	ZINC000262083595	605023378	/nfs/dbraw/zinc/02/33/78/605023378.db2.gz	BKHNIQDTKHBEAB-KRWDZBQOSA-N	-2	1	390.461	2.779	20	0		GFADML
CCC[C@@H](NC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-])C(=O)[O-]	ZINC000833649442	605023418	/nfs/dbraw/zinc/02/34/18/605023418.db2.gz	QTBPSOYQLQFZPC-OAHLLOKOSA-N	-2	1	392.358	2.906	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)c([O-])c1	ZINC000834254707	605641680	/nfs/dbraw/zinc/64/16/80/605641680.db2.gz	CBPPYINCKGQTHX-UHFFFAOYSA-N	-2	1	383.360	2.778	20	0		GFADML
CC(C)[C@H](C(=O)[O-])[C@H](C)[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000819089370	660246216	/nfs/dbraw/zinc/24/62/16/660246216.db2.gz	OHXKNZHIAVPSRJ-XVKPBYJWSA-N	-2	1	399.694	2.521	20	0		GFADML
CN(C)c1cc([N-]S(=O)(=O)c2c3ccccc3sc2C(=O)[O-])ccn1	ZINC000830631360	660667765	/nfs/dbraw/zinc/66/77/65/660667765.db2.gz	DILZNRAOGKXKHZ-UHFFFAOYSA-N	-2	1	377.447	2.861	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]NC(=O)c2ccc(Cl)cc2[O-])cc1Cl	ZINC000055664843	654779846	/nfs/dbraw/zinc/77/98/46/654779846.db2.gz	DCQGGEHUXYRLEI-UHFFFAOYSA-N	-2	1	375.233	2.631	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C)c(Cl)c(C(=O)[O-])c2)cc1C(N)=O	ZINC000759097885	655947592	/nfs/dbraw/zinc/94/75/92/655947592.db2.gz	RDSCZKRMOKRSTE-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C(Nc1cc(Cl)[nH]n1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000765028800	656126839	/nfs/dbraw/zinc/12/68/39/656126839.db2.gz	KKCCPTSRWCDHMO-UHFFFAOYSA-N	-2	1	398.853	2.883	20	0		GFADML
CC(C)(CCC[N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000776625250	656769484	/nfs/dbraw/zinc/76/94/84/656769484.db2.gz	YLYOOLAYAFUAFT-UHFFFAOYSA-N	-2	1	399.694	2.667	20	0		GFADML
CCC[C@@H](C(=O)OCC)S(=O)(=O)[N-]c1ccc(S[C@@H](C)C(=O)[O-])cc1	ZINC000844662117	661432872	/nfs/dbraw/zinc/43/28/72/661432872.db2.gz	MBABBNPDVZYSNE-FZMZJTMJSA-N	-2	1	389.495	2.725	20	0		GFADML
O=C([O-])[C@@H]1CCCCC[C@@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000128060145	551345947	/nfs/dbraw/zinc/34/59/47/551345947.db2.gz	FAHXSEOUSNAXAP-SCZZXKLOSA-N	-2	1	382.301	2.822	20	0		GFADML
CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C)c2c(=O)[n-]c(=O)nc-2[n-]1	ZINC000151541151	551416097	/nfs/dbraw/zinc/41/60/97/551416097.db2.gz	CHUWCJRBYALAKY-UHFFFAOYSA-N	-2	1	378.841	2.709	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2ccc(Br)c(Cl)c2Cl)CC1	ZINC000558591243	564907704	/nfs/dbraw/zinc/90/77/04/564907704.db2.gz	UCPHZFDILRZHFI-UHFFFAOYSA-N	-2	1	389.054	2.651	20	0		GFADML
NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1Cl	ZINC000327102955	563457196	/nfs/dbraw/zinc/45/71/96/563457196.db2.gz	MBDRMWVCIIZREX-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
COC(=O)c1cccc(Cl)c1S(=O)(=O)[N-]c1cccc(C(=O)[O-])c1F	ZINC000427299241	563464876	/nfs/dbraw/zinc/46/48/76/563464876.db2.gz	KTTOEKSDGWDJLW-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)CS3)cc1Cl	ZINC000393102981	563528544	/nfs/dbraw/zinc/52/85/44/563528544.db2.gz	CYUDJSFBEHOPIG-UHFFFAOYSA-N	-2	1	398.849	2.883	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)ccc1C(=O)[O-]	ZINC000432777923	563593157	/nfs/dbraw/zinc/59/31/57/563593157.db2.gz	BXWBNOQGJHCGOT-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
O=S(=O)([N-]c1cnn(CC(F)(F)F)c1)c1cc(C(F)(F)F)ccc1[O-]	ZINC000436480270	563672089	/nfs/dbraw/zinc/67/20/89/563672089.db2.gz	ZKJADVLHHYLYTF-UHFFFAOYSA-N	-2	1	389.277	2.971	20	0		GFADML
O=C(N[C@@H]1CCC[C@@H]1F)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436777224	563679358	/nfs/dbraw/zinc/67/93/58/563679358.db2.gz	YFUMBVVKOCWAFW-QWHCGFSZSA-N	-2	1	384.454	2.875	20	0		GFADML
CSc1cccc(C)c1[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000471959566	564209030	/nfs/dbraw/zinc/20/90/30/564209030.db2.gz	WNIFJUFVUORQOM-UHFFFAOYSA-N	-3	1	381.431	2.914	20	0		GFADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])cc1	ZINC000509653390	564308141	/nfs/dbraw/zinc/30/81/41/564308141.db2.gz	RSUCWEVMELIOFD-UHFFFAOYSA-N	-3	1	383.809	2.856	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2C)cc1	ZINC000476263579	564332158	/nfs/dbraw/zinc/33/21/58/564332158.db2.gz	XXEFLOSHUOSSOD-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(Cl)c(C)c(C(=O)[O-])c2)cc1C(N)=O	ZINC000479258316	564433865	/nfs/dbraw/zinc/43/38/65/564433865.db2.gz	OMPBJVOTKVLXLY-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=S(=O)([N-]Cc1ncccc1O)c1c(Cl)cc(F)cc1Br	ZINC000480735613	564485253	/nfs/dbraw/zinc/48/52/53/564485253.db2.gz	LEKAWRZNJUARAB-UHFFFAOYSA-N	-2	1	395.637	2.821	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)[C@H](C)C(=O)[O-]	ZINC000556702386	564836321	/nfs/dbraw/zinc/83/63/21/564836321.db2.gz	CLHSMPQZPDVVMY-WHFBIAKZSA-N	-2	1	376.681	2.552	20	0		GFADML
C[C@H]1CC[C@@](C[N-]S(=O)(=O)c2ncccc2C(F)(F)F)(CC(=O)[O-])C1	ZINC000650412964	565818366	/nfs/dbraw/zinc/81/83/66/565818366.db2.gz	WDBRZSMNGBFZLA-HZMBPMFUSA-N	-2	1	380.388	2.660	20	0		GFADML
CCO[C@H](CS(=O)(=O)[N-]c1cc(C(F)(F)F)ccc1C(=O)[O-])C1CC1	ZINC000629292608	565836659	/nfs/dbraw/zinc/83/66/59/565836659.db2.gz	RXRUKEHKFGMCQR-CYBMUJFWSA-N	-2	1	381.372	2.960	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]CC[C@H](CC(=O)[O-])C(F)(F)F)c(F)c1F	ZINC000629303957	565839955	/nfs/dbraw/zinc/83/99/55/565839955.db2.gz	PGZVHXZHZCOTJK-MRVPVSSYSA-N	-2	1	375.315	2.595	20	0		GFADML
CC(C)C1CN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C1	ZINC000677127492	565960077	/nfs/dbraw/zinc/96/00/77/565960077.db2.gz	JFULCBRXPQDUML-UHFFFAOYSA-N	-2	1	380.491	2.983	20	0		GFADML
COc1ccccc1C[C@H](C[N-]S(=O)(=O)c1sccc1Cl)C(=O)[O-]	ZINC000654770171	566021808	/nfs/dbraw/zinc/02/18/08/566021808.db2.gz	LBNQQNMPBSUQGK-LLVKDONJSA-N	-2	1	389.882	2.632	20	0		GFADML
O=c1c2c([n-]n1-c1ccc(S(=O)(=O)[N-]c3nccs3)cc1)CCCC2	ZINC000634617782	566162054	/nfs/dbraw/zinc/16/20/54/566162054.db2.gz	XWJSDMIFGJLOIY-CYBMUJFWSA-N	-2	1	376.463	2.837	20	0		GFADML
O=C([O-])[C@H](CNC(=O)c1cc(Br)ccc1[O-])Cc1ccc(O)cc1	ZINC000739396627	599717283	/nfs/dbraw/zinc/71/72/83/599717283.db2.gz	IMIUSDJQCCXSEB-NSHDSACASA-N	-2	1	394.221	2.534	20	0		GFADML
Cc1ccc(NC(=O)C(C)(C)NC(=O)[O-])cc1[N-]S(=O)(=O)c1ccccc1	ZINC000738618065	599733669	/nfs/dbraw/zinc/73/36/69/599733669.db2.gz	VWNOPQJPTKDCJO-UHFFFAOYSA-N	-2	1	391.449	2.781	20	0		GFADML
CC[C@H](C)[C@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1)C(=O)[O-]	ZINC000261817353	599742570	/nfs/dbraw/zinc/74/25/70/599742570.db2.gz	UCOGBIZWBRDQQQ-GUYCJALGSA-N	-2	1	390.461	2.717	20	0		GFADML
CC[C@@](C)(NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)c1ccccc1	ZINC000736861402	599761973	/nfs/dbraw/zinc/76/19/73/599761973.db2.gz	KYKDOEGSLCKORI-JOCHJYFZSA-N	-2	1	393.443	2.848	20	0		GFADML
C[C@H](CNC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2)c1)C(=O)[O-]	ZINC000485928018	599779897	/nfs/dbraw/zinc/77/98/97/599779897.db2.gz	AAAJVEJAWDALBQ-LLVKDONJSA-N	-2	1	396.852	2.591	20	0		GFADML
COC(=O)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cl)cc1F	ZINC000737718278	599814919	/nfs/dbraw/zinc/81/49/19/599814919.db2.gz	PUVJFWJTRRDHFN-UHFFFAOYSA-N	-2	1	393.801	2.826	20	0		GFADML
Cc1ccc(C(=O)N(C)CC(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cl)c1	ZINC000427716696	599851614	/nfs/dbraw/zinc/85/16/14/599851614.db2.gz	ACRLQWXANZNFQA-UHFFFAOYSA-N	-2	1	396.852	2.606	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000737602970	599853291	/nfs/dbraw/zinc/85/32/91/599853291.db2.gz	CSSUIGKQAOZBLM-UHFFFAOYSA-N	-2	1	397.836	2.945	20	0		GFADML
CC(=O)Nc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(OCC(=O)[O-])cc1	ZINC000517300991	599938290	/nfs/dbraw/zinc/93/82/90/599938290.db2.gz	ZGMCKHCQMGMNSI-UHFFFAOYSA-N	-2	1	398.824	2.563	20	0		GFADML
Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc1)CC2	ZINC000738671137	600075497	/nfs/dbraw/zinc/07/54/97/600075497.db2.gz	SORPTTFYZNLSCW-LJQANCHMSA-N	-2	1	391.427	2.518	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)Nc2ccc(F)c(NC(=O)[O-])c2)o1	ZINC000736261121	600087058	/nfs/dbraw/zinc/08/70/58/600087058.db2.gz	AJEHZNPNNSLXJC-UHFFFAOYSA-N	-2	1	399.400	2.838	20	0		GFADML
C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736764864	600184173	/nfs/dbraw/zinc/18/41/73/600184173.db2.gz	XFNBZBOBYCLTDU-QIIPPGSGSA-N	-2	1	383.448	2.586	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)ccc1F	ZINC000736160877	600256191	/nfs/dbraw/zinc/25/61/91/600256191.db2.gz	MZXMPHNNJAPQDS-UHFFFAOYSA-N	-2	1	395.412	2.695	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)c1	ZINC000609985890	600396094	/nfs/dbraw/zinc/39/60/94/600396094.db2.gz	TZRCGXAINAPYER-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
Cc1cc(C(=O)[O-])ccc1S(=O)(=O)[N-]c1ccc(N2CCCC2=O)c(F)c1	ZINC000466272758	600458023	/nfs/dbraw/zinc/45/80/23/600458023.db2.gz	QBSGTSWTQINJDI-UHFFFAOYSA-N	-2	1	392.408	2.760	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(-c3noc(C)n3)c2)cc1C(=O)[O-]	ZINC000363383756	600543726	/nfs/dbraw/zinc/54/37/26/600543726.db2.gz	AJYFXEQXTCGKFX-UHFFFAOYSA-N	-2	1	389.389	2.553	20	0		GFADML
CC(C)N(CCC(=O)[O-])C(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000262463766	600596674	/nfs/dbraw/zinc/59/66/74/600596674.db2.gz	SSAVNIQZFQUMKC-UHFFFAOYSA-N	-2	1	390.461	2.813	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NC(C)C)cc2C)cc1C(=O)[O-]	ZINC000517127595	600813052	/nfs/dbraw/zinc/81/30/52/600813052.db2.gz	XGSWMTOHIQLCRC-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2ccc(C(C)(C)C)cc2C(=O)[O-])cc1C(=O)[O-]	ZINC000511713536	600813299	/nfs/dbraw/zinc/81/32/99/600813299.db2.gz	FSTZRVVDNXSQQZ-UHFFFAOYSA-N	-3	1	380.422	2.520	20	0		GFADML
O=C([O-])c1ccsc1N1CC[C@H](NC(=O)c2ccc3ccccc3c2[O-])C1=O	ZINC000833341870	601068654	/nfs/dbraw/zinc/06/86/54/601068654.db2.gz	RXJYHAXKKDOESO-HNNXBMFYSA-N	-2	1	396.424	2.840	20	0		GFADML
COc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(Cl)ccc1C(=O)[O-]	ZINC000737950024	601120486	/nfs/dbraw/zinc/12/04/86/601120486.db2.gz	WICYNRPXTUQMBQ-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc([S@@](=O)C(F)(F)F)cc2)cc1	ZINC000748676216	601126887	/nfs/dbraw/zinc/12/68/87/601126887.db2.gz	YGDWVPUTHAYLIQ-XMMPIXPASA-N	-2	1	393.364	2.813	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc(OC)c1OC	ZINC000832027216	601317215	/nfs/dbraw/zinc/31/72/15/601317215.db2.gz	VYAAQDWCYSIXDX-TWGQIWQCSA-N	-2	1	393.417	2.611	20	0		GFADML
CCNC(=O)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000013079252	601318836	/nfs/dbraw/zinc/31/88/36/601318836.db2.gz	PVBRUYZDJJDNJS-UHFFFAOYSA-N	-2	1	376.434	2.552	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(C(=O)NC3CC3)cc2)c1C	ZINC000013460421	601320056	/nfs/dbraw/zinc/32/00/56/601320056.db2.gz	SLADNTSAFWYBEE-UHFFFAOYSA-N	-2	1	388.445	2.695	20	0		GFADML
Cc1ccc(N2CCOC2=O)cc1[N-]S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000743268003	601333370	/nfs/dbraw/zinc/33/33/70/601333370.db2.gz	AFMMMYAUTDTIJR-UHFFFAOYSA-N	-2	1	394.380	2.590	20	0		GFADML
CC[C@H](NC(=O)c1cccc([N-]S(=O)(=O)c2cc(F)ccc2C)c1)C(=O)[O-]	ZINC000828976413	601761741	/nfs/dbraw/zinc/76/17/41/601761741.db2.gz	OJCFKWTVYSAMNY-HNNXBMFYSA-N	-2	1	394.424	2.528	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1C	ZINC000751141456	601840860	/nfs/dbraw/zinc/84/08/60/601840860.db2.gz	CJQCUPDIWSJOQL-UHFFFAOYSA-N	-2	1	385.344	2.559	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(OC[C@@H]2CCCO2)cc1	ZINC000833295283	601858401	/nfs/dbraw/zinc/85/84/01/601858401.db2.gz	UQJPHJCOLQWAMU-AWEZNQCLSA-N	-2	1	395.408	2.883	20	0		GFADML
CCOC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000829857144	601859959	/nfs/dbraw/zinc/85/99/59/601859959.db2.gz	JBWOWBZFNUNASP-UHFFFAOYSA-N	-2	1	396.396	2.917	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccc(C(=O)[O-])c(F)c1	ZINC000761745789	601876454	/nfs/dbraw/zinc/87/64/54/601876454.db2.gz	LTMKHKHRGGSMRY-UHFFFAOYSA-N	-2	1	380.397	2.928	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1F)c1noc(-c2ccccc2)n1	ZINC000827747308	602172124	/nfs/dbraw/zinc/17/21/24/602172124.db2.gz	LQIJAQNMTVBAET-JTQLQIEISA-N	-2	1	391.380	2.613	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])c(C)c1	ZINC000739790442	602243757	/nfs/dbraw/zinc/24/37/57/602243757.db2.gz	AHYIMDPDRVAZEK-UHFFFAOYSA-N	-2	1	390.417	2.623	20	0		GFADML
CS(=O)(=O)c1cc(NC(=O)c2ccc3ccccc3c2[O-])cc(C(=O)[O-])c1	ZINC000832712997	602300532	/nfs/dbraw/zinc/30/05/32/602300532.db2.gz	ANZRGLMAPMHKNG-UHFFFAOYSA-N	-2	1	385.397	2.899	20	0		GFADML
O=C([O-])c1cc2c(c(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(F)c3)c1)CCC2	ZINC000533166783	602322485	/nfs/dbraw/zinc/32/24/85/602322485.db2.gz	CSKZQDOUNROGEJ-UHFFFAOYSA-N	-3	1	379.365	2.512	20	0		GFADML
CC[C@H](NC(=O)[O-])C(=O)Nc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000739534679	602395408	/nfs/dbraw/zinc/39/54/08/602395408.db2.gz	OCFGDSQTNZAXFU-HNNXBMFYSA-N	-2	1	391.449	2.781	20	0		GFADML
COc1cc(C)c(S(=O)(=O)[N-]c2cccc(CNC(=O)[O-])c2)cc1OC	ZINC000739856485	602655530	/nfs/dbraw/zinc/65/55/30/602655530.db2.gz	KLLVACWOGRBLBX-UHFFFAOYSA-N	-2	1	380.422	2.581	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2ccnc(OCC(F)(F)F)c2)c([O-])c1	ZINC000740699159	602849760	/nfs/dbraw/zinc/84/97/60/602849760.db2.gz	UKUZLIKOVZSMSQ-UHFFFAOYSA-N	-2	1	385.298	2.748	20	0		GFADML
C[C@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1cccc(N2CCOC2=O)c1	ZINC000739021626	602854103	/nfs/dbraw/zinc/85/41/03/602854103.db2.gz	FPORBNHSOMWCHT-NSHDSACASA-N	-2	1	385.376	2.930	20	0		GFADML
COC(=O)C=Cc1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])cc2)cc1	ZINC000828646165	603578878	/nfs/dbraw/zinc/57/88/78/603578878.db2.gz	GGMJCSOJWBJJBF-WCIBSUBMSA-N	-2	1	376.390	2.764	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)OC[C@H](C)NC(=O)[O-])cc1	ZINC000830587432	604204643	/nfs/dbraw/zinc/20/46/43/604204643.db2.gz	XCTUIUZICPLVHQ-ZDUSSCGKSA-N	-2	1	392.433	2.609	20	0		GFADML
CC(C)(C)C1=CCN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CC1	ZINC000833427379	604836126	/nfs/dbraw/zinc/83/61/26/604836126.db2.gz	NZSDJDOYZYCLJO-UHFFFAOYSA-N	-2	1	383.448	2.611	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCOC[C@H]2C[C@@H](O)c2cccs2)c([O-])c1	ZINC000834258549	605655923	/nfs/dbraw/zinc/65/59/23/605655923.db2.gz	QMZWRSWZISUEAD-IUODEOHRSA-N	-2	1	392.433	2.508	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC(CCN(C)C(=O)[O-])CC1	ZINC000833912780	605668315	/nfs/dbraw/zinc/66/83/15/605668315.db2.gz	OYFHODIBHNMPAZ-UHFFFAOYSA-N	-2	1	378.473	2.640	20	0		GFADML
Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ncc(-c3nn[n-]n3)s2)c(C)c1C	ZINC000822020408	607026205	/nfs/dbraw/zinc/02/62/05/607026205.db2.gz	CCTNNMHQSGNEOV-UHFFFAOYSA-N	-2	1	378.483	2.666	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(CC(=O)[O-])cc2)c1Cl	ZINC000762433981	656041829	/nfs/dbraw/zinc/04/18/29/656041829.db2.gz	YSCIUABLXPWUNS-UHFFFAOYSA-N	-2	1	383.809	2.775	20	0		GFADML
O=C([O-])C[C@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1cccs1	ZINC000776443560	656742261	/nfs/dbraw/zinc/74/22/61/656742261.db2.gz	RYQWBBQIPCNZOF-QMMMGPOBSA-N	-2	1	381.262	2.944	20	0		GFADML
C[C@H]1CC[C@@](C[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)(CC(=O)[O-])C1	ZINC000776626199	656770200	/nfs/dbraw/zinc/77/02/00/656770200.db2.gz	LLSWVBKKENEJHW-XPTSAGLGSA-N	-2	1	381.281	2.948	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2c(F)cccc2CO)c(F)c(Cl)c1F	ZINC000779837387	656948162	/nfs/dbraw/zinc/94/81/62/656948162.db2.gz	OCBQSSNQNQLSHM-UHFFFAOYSA-N	-2	1	395.742	2.749	20	0		GFADML
O=C([O-])/C=C\C[N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl	ZINC000788448233	657720513	/nfs/dbraw/zinc/72/05/13/657720513.db2.gz	QUQIVJNZDVKUCV-UPHRSURJSA-N	-2	1	389.054	2.675	20	0		GFADML
CC(C)(C)[C@@H]1C[C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CCO1	ZINC000871929662	662743191	/nfs/dbraw/zinc/74/31/91/662743191.db2.gz	FMBHGCPVNRZTFG-GWCFXTLKSA-N	-2	1	377.409	2.535	20	0		GFADML
Cn1ncc([N-]S(=O)(=O)c2c([O-])cccc2OC(F)(F)F)c1C1CC1	ZINC000901909681	663750591	/nfs/dbraw/zinc/75/05/91/663750591.db2.gz	ABKGRIQDTWQQNM-UHFFFAOYSA-N	-2	1	377.344	2.703	20	0		GFADML
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1c(F)cc(F)cc1F)c1ccc(F)cc1	ZINC000918726538	664503593	/nfs/dbraw/zinc/50/35/93/664503593.db2.gz	QHMHOWQSYPYVEL-CYBMUJFWSA-N	-2	1	377.315	2.737	20	0		GFADML
O=C([O-])C[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000309696219	563435264	/nfs/dbraw/zinc/43/52/64/563435264.db2.gz	DKCZTJIMDCKSAF-WPRPVWTQSA-N	-2	1	382.301	2.822	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2F)c(Cl)c1	ZINC000427339970	563465904	/nfs/dbraw/zinc/46/59/04/563465904.db2.gz	XULXLXAWEFUKEQ-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc3ncsc3c2)cc1CC(=O)[O-]	ZINC000538138292	564183226	/nfs/dbraw/zinc/18/32/26/564183226.db2.gz	OTBVKCMILVSHNA-UHFFFAOYSA-N	-2	1	378.431	2.733	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2oc(=O)[nH]c2c1	ZINC000476278375	564333185	/nfs/dbraw/zinc/33/31/85/564333185.db2.gz	RHXPUTVOILZVDT-UHFFFAOYSA-N	-2	1	382.781	2.994	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc([S@](C)=O)cc1	ZINC000476424777	564338969	/nfs/dbraw/zinc/33/89/69/564338969.db2.gz	HLGLRNCOOGJLQV-QHCPKHFHSA-N	-2	1	387.866	2.885	20	0		GFADML
Cc1c(C[S@](C)=O)cccc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000477413710	564375900	/nfs/dbraw/zinc/37/59/00/564375900.db2.gz	DMDUICQGLLLLEM-DEOSSOPVSA-N	-2	1	381.475	2.681	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1cccc([S@@](C)=O)c1	ZINC000479364644	564437123	/nfs/dbraw/zinc/43/71/23/564437123.db2.gz	OPFLLPFBOVIWIU-HSZRJFAPSA-N	-2	1	387.866	2.885	20	0		GFADML
Cc1ccc([C@@H]([N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C(=O)[O-])cc1	ZINC000547547867	564493446	/nfs/dbraw/zinc/49/34/46/564493446.db2.gz	DCHOFPSVOSNDJD-CYBMUJFWSA-N	-2	1	384.797	2.661	20	0		GFADML
C[C@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000547609702	564502401	/nfs/dbraw/zinc/50/24/01/564502401.db2.gz	VUAICDGTMUDDOR-RXMQYKEDSA-N	-2	1	376.681	2.696	20	0		GFADML
O=C([O-])[C@H](CC(=O)c1cccs1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000548212201	564536650	/nfs/dbraw/zinc/53/66/50/564536650.db2.gz	LHMHUQGWACIONY-JTQLQIEISA-N	-2	1	391.829	2.545	20	0		GFADML
COc1cc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)c(Cl)cc1C(=O)[O-]	ZINC000485271938	564611442	/nfs/dbraw/zinc/61/14/42/564611442.db2.gz	IAMUARKKABNLCQ-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
Cc1cc(Br)cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2[O-])c1	ZINC000486104159	564639167	/nfs/dbraw/zinc/63/91/67/564639167.db2.gz	ARDCAQHXEPLTMR-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
COC(=O)c1csc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c1	ZINC000573656719	564648059	/nfs/dbraw/zinc/64/80/59/564648059.db2.gz	UOPMOJIAOPCOIF-UHFFFAOYSA-N	-2	1	375.811	2.687	20	0		GFADML
O=C([O-])CC[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000582650341	564856480	/nfs/dbraw/zinc/85/64/80/564856480.db2.gz	OKDLTIVAKUNBOJ-NXEZZACHSA-N	-2	1	380.260	2.744	20	0		GFADML
O=C([O-])[C@H](CCc1ccc(F)cc1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000560076345	564948639	/nfs/dbraw/zinc/94/86/39/564948639.db2.gz	CXFPQNIUYJTMRR-AWEZNQCLSA-N	-2	1	389.807	2.983	20	0		GFADML
C[C@H](CSCC[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Cl)C(=O)[O-]	ZINC000593273313	565323032	/nfs/dbraw/zinc/32/30/32/565323032.db2.gz	HCLLEEZYPXZUBL-SSDOTTSWSA-N	-2	1	390.285	2.865	20	0		GFADML
O=C(N[C@@H]1C[C@H]2C[C@H]2C1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000644849422	565497847	/nfs/dbraw/zinc/49/78/47/565497847.db2.gz	CJGCUPLFJGKHJZ-PTEHBNRSSA-N	-2	1	378.475	2.783	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2cc(C(C)(C)C)n[nH]2)c(Cl)cc1C(=O)[O-]	ZINC000675549914	565909290	/nfs/dbraw/zinc/90/92/90/565909290.db2.gz	XBAVEUKNGWNHID-UHFFFAOYSA-N	-2	1	387.845	2.868	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H]2CCCC[C@@H]2CCC(=O)[O-])c(F)c1	ZINC000654779532	566022681	/nfs/dbraw/zinc/02/26/81/566022681.db2.gz	QADHOSHGYZMIJP-QMTHXVAHSA-N	-2	1	377.409	2.675	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(C(=O)N(C)CCC(=O)[O-])cc2)c1	ZINC000262904166	597010342	/nfs/dbraw/zinc/01/03/42/597010342.db2.gz	QRCQLMJPOLSMMC-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
O=C([O-])[C@@H]1CCCCN1C(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1	ZINC000262667731	597443583	/nfs/dbraw/zinc/44/35/83/597443583.db2.gz	OBXISSQJWVNGCV-KRWDZBQOSA-N	-2	1	388.445	2.567	20	0		GFADML
CN(C)C(=O)Sc1ccccc1[N-]S(=O)(=O)c1ccc(O)c(C(=O)[O-])c1	ZINC000737351492	599752973	/nfs/dbraw/zinc/75/29/73/599752973.db2.gz	HFNUJRDQOZDDDX-UHFFFAOYSA-N	-2	1	396.446	2.665	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)Nc1ccc(CCC(=O)[O-])cc1	ZINC000372908644	599770731	/nfs/dbraw/zinc/77/07/31/599770731.db2.gz	REXMTMXJQNQYAM-UHFFFAOYSA-N	-2	1	392.415	2.751	20	0		GFADML
O=C([O-])c1ccc(NCc2ccccc2[N-]S(=O)(=O)c2ccccc2)nn1	ZINC000740154485	599843659	/nfs/dbraw/zinc/84/36/59/599843659.db2.gz	CSWBGOJHENHSAS-UHFFFAOYSA-N	-2	1	384.417	2.588	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)[O-])c1C	ZINC000737713035	599905391	/nfs/dbraw/zinc/90/53/91/599905391.db2.gz	KMXDRSHXYBINPX-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(NC(=O)NC2CC2)cc1	ZINC000477409060	599906253	/nfs/dbraw/zinc/90/62/53/599906253.db2.gz	YMMPSUNVTGFNGH-UHFFFAOYSA-N	-2	1	389.433	2.778	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1cccc(CN2CCCC2=O)c1	ZINC000675628093	599906306	/nfs/dbraw/zinc/90/63/06/599906306.db2.gz	HIBKCYGMSHWPIS-UHFFFAOYSA-N	-2	1	388.445	2.616	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)nc2)cc1	ZINC000588832575	599981628	/nfs/dbraw/zinc/98/16/28/599981628.db2.gz	LAFDBAIUMZQGRX-UHFFFAOYSA-N	-2	1	392.433	2.667	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2cc(C(=O)[O-])c(C)cc2C)c1	ZINC000511689382	600006252	/nfs/dbraw/zinc/00/62/52/600006252.db2.gz	WHQYZIIOICHOCN-UHFFFAOYSA-N	-3	1	379.390	2.509	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(-n2cncn2)c(Cl)c1	ZINC000740144354	600098515	/nfs/dbraw/zinc/09/85/15/600098515.db2.gz	MVGFQGXZMSVHMM-UHFFFAOYSA-N	-2	1	396.787	2.559	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(-c2nc(-c3ccc(C(=O)[O-])cc3)no2)o1	ZINC000736262909	600115165	/nfs/dbraw/zinc/11/51/65/600115165.db2.gz	QFOMLQQRVNAZCA-UHFFFAOYSA-N	-2	1	391.405	2.772	20	0		GFADML
Cc1cc(C)cc([C@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000738363593	600154770	/nfs/dbraw/zinc/15/47/70/600154770.db2.gz	KMLLSVXSRFINFO-HNNXBMFYSA-N	-2	1	393.443	2.901	20	0		GFADML
CCN(C(=O)CCc1c(C)nc(SC)[n-]c1=O)c1ccccc1C(=O)[O-]	ZINC000737053472	600532027	/nfs/dbraw/zinc/53/20/27/600532027.db2.gz	QJNFZHXHHFNOKP-UHFFFAOYSA-N	-2	1	375.450	2.896	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(-c3csnn3)cc2)cc1C(=O)[O-]	ZINC000057120277	600543720	/nfs/dbraw/zinc/54/37/20/600543720.db2.gz	YSKDYOJZKDHJOP-UHFFFAOYSA-N	-2	1	391.430	2.713	20	0		GFADML
O=C([O-])c1cc(Br)cc(S(=O)(=O)[N-]c2ccc3n[nH]cc3c2)c1	ZINC000740069326	600576982	/nfs/dbraw/zinc/57/69/82/600576982.db2.gz	UTTFXYRDOUNHEL-UHFFFAOYSA-N	-2	1	396.222	2.824	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2cccc(OC[C@@H]3CCCO3)c2)cc1	ZINC000267203814	600626313	/nfs/dbraw/zinc/62/63/13/600626313.db2.gz	QXWCQAONRRPOFV-KRWDZBQOSA-N	-2	1	391.445	2.672	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3cccc(C(=O)[O-])c3C)cc21	ZINC000265463904	600633982	/nfs/dbraw/zinc/63/39/82/600633982.db2.gz	UROQMHMHWKWAJC-UHFFFAOYSA-N	-2	1	388.445	2.793	20	0		GFADML
O=C([O-])NCc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000833280628	600684243	/nfs/dbraw/zinc/68/42/43/600684243.db2.gz	NNNAGWHUHOKNJI-UHFFFAOYSA-N	-3	1	384.797	2.607	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)ccc1C(=O)N(C)C	ZINC000477394036	600694136	/nfs/dbraw/zinc/69/41/36/600694136.db2.gz	QZQMSDPJPQQANF-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cccs1)c1nc(-c2cccc(C(=O)[O-])c2)no1	ZINC000827759825	600697581	/nfs/dbraw/zinc/69/75/81/600697581.db2.gz	AIOZCDKQAGKNIE-SECBINFHSA-N	-2	1	379.419	2.536	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2cccc(C[S@](=O)C(C)(C)C)c2)cc1C(=O)[O-]	ZINC000265280661	600815774	/nfs/dbraw/zinc/81/57/74/600815774.db2.gz	OOCZMLIHCXOUKR-VWLOTQADSA-N	-2	1	398.506	2.571	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2ccc(N3CCCC3)c(Cl)c2)cc1C(=O)[O-]	ZINC000730768842	600816432	/nfs/dbraw/zinc/81/64/32/600816432.db2.gz	SWTNOIDADOOSEL-UHFFFAOYSA-N	-2	1	383.857	2.778	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)ccc1F	ZINC000737663499	600888354	/nfs/dbraw/zinc/88/83/54/600888354.db2.gz	AEQCJFUQDNBANB-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(CCC(=O)[O-])cc2)cc1	ZINC000265791721	600898844	/nfs/dbraw/zinc/89/88/44/600898844.db2.gz	UQWVIVSQQNZRRK-UHFFFAOYSA-N	-3	1	391.445	2.867	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)N1C[C@H](CC(=O)[O-])c2ccccc21	ZINC000737226416	600907941	/nfs/dbraw/zinc/90/79/41/600907941.db2.gz	LNRHIIFPRSXUEJ-ZDUSSCGKSA-N	-2	1	388.445	2.667	20	0		GFADML
CSc1nc(C)c(CCC(=O)N(CCC(=O)[O-])c2cccc(F)c2)c(=O)[n-]1	ZINC000738207193	601028749	/nfs/dbraw/zinc/02/87/49/601028749.db2.gz	AZCSLRYLNHPWEC-UHFFFAOYSA-N	-2	1	393.440	2.792	20	0		GFADML
COc1cc(C(=O)[O-])sc1S(=O)(=O)[N-]c1cc2c(cc1Cl)OCO2	ZINC000831945539	601150336	/nfs/dbraw/zinc/15/03/36/601150336.db2.gz	JZAJFCIOKXZSFH-UHFFFAOYSA-N	-2	1	391.810	2.638	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1Cl	ZINC000831015818	601326021	/nfs/dbraw/zinc/32/60/21/601326021.db2.gz	IZTMSPZNFNJVKB-RUDMXATFSA-N	-2	1	394.836	2.598	20	0		GFADML
C[C@H]1CCCN1C(=O)c1ccc(-c2nc3cc(C(=O)[O-])ccc3c(=O)[n-]2)cc1	ZINC000828271563	601397375	/nfs/dbraw/zinc/39/73/75/601397375.db2.gz	FVZHOEBMCHLNDI-LBPRGKRZSA-N	-2	1	377.400	2.913	20	0		GFADML
CC[C@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1)C(=O)[O-]	ZINC000828976412	601750774	/nfs/dbraw/zinc/75/07/74/601750774.db2.gz	OGUBWKDLIAMAMV-HNNXBMFYSA-N	-2	1	396.852	2.734	20	0		GFADML
CC[C@@H](NC(=O)c1cccc([N-]S(=O)(=O)c2cc(C)ccc2C)c1)C(=O)[O-]	ZINC000263030336	601753768	/nfs/dbraw/zinc/75/37/68/601753768.db2.gz	ULJYRSXWFFULFU-MRXNPFEDSA-N	-2	1	390.461	2.697	20	0		GFADML
COc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1	ZINC000743264188	601830124	/nfs/dbraw/zinc/83/01/24/601830124.db2.gz	SJZOPHQSYKLIFJ-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
O=C([O-])c1cc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)ccc1F	ZINC000746350570	601833343	/nfs/dbraw/zinc/83/33/43/601833343.db2.gz	IWIRNVFAONBAHD-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(Cn3cccn3)c2)cc(F)c1F	ZINC000751145360	601834297	/nfs/dbraw/zinc/83/42/97/601834297.db2.gz	FHOVQLQYHFEKAM-UHFFFAOYSA-N	-2	1	393.371	2.709	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(CN(C)C(=O)[O-])cc1	ZINC000832852792	601985113	/nfs/dbraw/zinc/98/51/13/601985113.db2.gz	KTEXBTCCAZXTQP-UHFFFAOYSA-N	-3	1	378.406	2.604	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2cc(C)c(C)c(C(=O)[O-])c2)c1	ZINC000471136219	602114040	/nfs/dbraw/zinc/11/40/40/602114040.db2.gz	JCVBWFIDLQFXLE-UHFFFAOYSA-N	-3	1	379.390	2.509	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1cc(CCc2ccccc2)n[nH]1	ZINC000833318200	602308603	/nfs/dbraw/zinc/30/86/03/602308603.db2.gz	JDVUCQKVYOINIM-UHFFFAOYSA-N	-2	1	389.408	2.833	20	0		GFADML
O=C([O-])CCOc1ccc(S(=O)(=O)[N-]c2cc(C3CCCC3)n[nH]2)cc1	ZINC000833239525	602308769	/nfs/dbraw/zinc/30/87/69/602308769.db2.gz	RQNJKLICYDZBEG-UHFFFAOYSA-N	-2	1	379.438	2.722	20	0		GFADML
CC(C)C[C@H](NC(=O)[O-])c1noc([C@@H](C)[N-]S(=O)(=O)c2cccs2)n1	ZINC000738817947	602408387	/nfs/dbraw/zinc/40/83/87/602408387.db2.gz	VTDNQHUCAIUSOK-ZJUUUORDSA-N	-2	1	388.471	2.525	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)c(C)c1	ZINC000739791718	602655740	/nfs/dbraw/zinc/65/57/40/602655740.db2.gz	JULOVJZQLKYBKF-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccccc2CN(C)C(=O)[O-])ccc1C	ZINC000738562214	602779125	/nfs/dbraw/zinc/77/91/25/602779125.db2.gz	RVGZFWMDJREKGN-UHFFFAOYSA-N	-2	1	391.449	2.864	20	0		GFADML
CN(CC(=O)Nc1ccccc1Cl)C(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000739627887	602844293	/nfs/dbraw/zinc/84/42/93/602844293.db2.gz	HKCWUITYURUGSI-UHFFFAOYSA-N	-2	1	377.784	2.846	20	0		GFADML
COc1cc([C@H](C)NC(=O)c2ccc(NC(=O)[O-])cc2[O-])cc(OC)c1OC	ZINC000739850210	602848722	/nfs/dbraw/zinc/84/87/22/602848722.db2.gz	IPPDWLLZDXCIRH-JTQLQIEISA-N	-2	1	390.392	2.999	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NC[C@H]2CCCN(C(=O)[O-])C2)c([O-])c1	ZINC000738722257	602856097	/nfs/dbraw/zinc/85/60/97/602856097.db2.gz	CLDMVKRSFHROKR-GFCCVEGCSA-N	-2	1	393.440	2.859	20	0		GFADML
Cc1ccc(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])c(O[C@@H]2CCOC2)c1	ZINC000830316620	604297979	/nfs/dbraw/zinc/29/79/79/604297979.db2.gz	ABBZDVVZRRHQJT-OAHLLOKOSA-N	-2	1	386.404	2.888	20	0		GFADML
Cc1ccc(-c2n[nH]c([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)c2C)o1	ZINC000135407099	604808174	/nfs/dbraw/zinc/80/81/74/604808174.db2.gz	VIXVIJPYVDVALS-UHFFFAOYSA-N	-2	1	379.369	2.925	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)ccc1NC(C)=O	ZINC000438793796	604990185	/nfs/dbraw/zinc/99/01/85/604990185.db2.gz	QHLJLZAOSUPZFO-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
O=C([O-])N[C@@H]1CCC[C@@H]2CN(C(=O)c3cc(Br)ccc3[O-])C[C@H]21	ZINC000834184360	605495201	/nfs/dbraw/zinc/49/52/01/605495201.db2.gz	VWYKIOKVJBHRSQ-OASPWFOLSA-N	-2	1	383.242	2.663	20	0		GFADML
CN(C)C(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2cc(C(=O)[O-])cs2)c1	ZINC000032592241	654606062	/nfs/dbraw/zinc/60/60/62/654606062.db2.gz	ZKNVRUCOTIYLJN-UHFFFAOYSA-N	-2	1	388.854	2.602	20	0		GFADML
Cc1ccc(Cl)c(S(=O)(=O)[N-][C@@H](CC(F)(F)F)C(=O)[O-])c1Cl	ZINC000275233687	655224443	/nfs/dbraw/zinc/22/44/43/655224443.db2.gz	JMHOVXLSEQLXNV-ZETCQYMHSA-N	-2	1	380.171	2.986	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc3c(c2)OCCO3)cc(C(=O)[O-])c1Cl	ZINC000759092638	655947107	/nfs/dbraw/zinc/94/71/07/655947107.db2.gz	XGJMBVOIVOUAKA-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]C[C@H](CC2CCCC2)C(=O)[O-])c(F)c1	ZINC000776556347	656757461	/nfs/dbraw/zinc/75/74/61/656757461.db2.gz	YYOBJWUJNQPSKT-NSHDSACASA-N	-2	1	377.409	2.533	20	0		GFADML
O=C([O-])c1ccccc1CC[N-]S(=O)(=O)c1c(Cl)ccnc1Cl	ZINC000776615081	656767045	/nfs/dbraw/zinc/76/70/45/656767045.db2.gz	UKESIUJNWYDGOZ-UHFFFAOYSA-N	-2	1	375.233	2.608	20	0		GFADML
CC[C@@H](C)C[C@@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000776616677	656768103	/nfs/dbraw/zinc/76/81/03/656768103.db2.gz	VOKSOOWSJKXTNQ-VXNVDRBHSA-N	-2	1	399.694	2.665	20	0		GFADML
CNC(=O)Oc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000793464394	658399120	/nfs/dbraw/zinc/39/91/20/658399120.db2.gz	QSBAAYAYTMNMNJ-UHFFFAOYSA-N	-2	1	384.797	2.557	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2F)c1Cl	ZINC000814218095	660074698	/nfs/dbraw/zinc/07/46/98/660074698.db2.gz	RQPYPGLHCYOJQD-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CC(C)OC[C@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)[O-]	ZINC000863418713	662329355	/nfs/dbraw/zinc/32/93/55/662329355.db2.gz	AUYBNKJSUWVDDU-JTQLQIEISA-N	-2	1	390.672	2.803	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@H]([N-]S(=O)(=O)c1cc(F)c(F)cc1F)CCS2	ZINC000899949150	663703789	/nfs/dbraw/zinc/70/37/89/663703789.db2.gz	MXMQXWNESWUASR-OSPBMLLASA-N	-2	1	395.424	2.511	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@@H]([N-]S(=O)(=O)c1ccc(F)c(F)c1F)CCS2	ZINC000899950097	663703974	/nfs/dbraw/zinc/70/39/74/663703974.db2.gz	WGIDPEQPVIHBJX-WWNCPBBQSA-N	-2	1	395.424	2.511	20	0		GFADML
COc1ccc(Br)c(S(=O)(=O)[N-][C@H](C)CCCC(=O)[O-])c1F	ZINC000903838351	663808200	/nfs/dbraw/zinc/80/82/00/663808200.db2.gz	LHLFXRZVZGXEPU-MRVPVSSYSA-N	-2	1	398.250	2.519	20	0		GFADML
CCOc1cc(C(=O)N2CC[C@](C(=O)[O-])(C(F)(F)F)C2)cc(Cl)c1[O-]	ZINC000909758327	664173075	/nfs/dbraw/zinc/17/30/75/664173075.db2.gz	JUIJGMJMHHMBIN-AWEZNQCLSA-N	-2	1	381.734	2.924	20	0		GFADML
O=C(NC[C@H]1CCSC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000279250290	563289213	/nfs/dbraw/zinc/28/92/13/563289213.db2.gz	RUBKABFLPGYOSA-LLVKDONJSA-N	-2	1	398.531	2.737	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(NC(=O)C2CC2)cc1	ZINC000327440702	563457962	/nfs/dbraw/zinc/45/79/62/563457962.db2.gz	RACOPUBVRPEHIQ-UHFFFAOYSA-N	-2	1	380.447	2.904	20	0		GFADML
CC(=O)Nc1cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2[O-])ccc1Cl	ZINC000433502432	563614618	/nfs/dbraw/zinc/61/46/18/563614618.db2.gz	PMLRKMJKKLHLKA-UHFFFAOYSA-N	-2	1	384.797	2.503	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(OC3COC3)cc2)c(Cl)c1	ZINC000436199327	563667696	/nfs/dbraw/zinc/66/76/96/563667696.db2.gz	PKYUIRBGXSRHRA-UHFFFAOYSA-N	-2	1	383.809	2.617	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2O)cc1O	ZINC000436478558	563670945	/nfs/dbraw/zinc/67/09/45/563670945.db2.gz	QXDWDTSQLZRKFP-UHFFFAOYSA-N	-2	1	377.296	2.616	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCC[C@H](F)C1	ZINC000563328833	564186178	/nfs/dbraw/zinc/18/61/78/564186178.db2.gz	AIOJVPYZRSYUNU-NSHDSACASA-N	-2	1	384.454	2.829	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cccc(Cl)c1C(=O)[O-]	ZINC000509662473	564309287	/nfs/dbraw/zinc/30/92/87/564309287.db2.gz	CUUZVZWMKJSDEP-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1NS(=O)(=O)c1cc(C(=O)[O-])ccc1[O-]	ZINC000475739798	564317135	/nfs/dbraw/zinc/31/71/35/564317135.db2.gz	XCAGLGCGPKIZIR-UHFFFAOYSA-N	-3	1	385.781	2.551	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc(NC(N)=O)cc2)cc1C(=O)[O-]	ZINC000479254780	564433755	/nfs/dbraw/zinc/43/37/55/564433755.db2.gz	NQNOGCNTAPFKLJ-UHFFFAOYSA-N	-2	1	383.813	2.638	20	0		GFADML
COc1cc(Br)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2)c1	ZINC000546153159	564446714	/nfs/dbraw/zinc/44/67/14/564446714.db2.gz	OAUYCJDZYMRDMH-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
CC(C)CCOc1ccccc1C[N-]S(=O)(=O)c1csnc1C(=O)[O-]	ZINC000569841351	564480264	/nfs/dbraw/zinc/48/02/64/564480264.db2.gz	SHACABNRXWVMTE-UHFFFAOYSA-N	-2	1	384.479	2.745	20	0		GFADML
COC(=O)c1csc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c1	ZINC000548526212	564555774	/nfs/dbraw/zinc/55/57/74/564555774.db2.gz	ZUCGLXBTAGEEGD-UHFFFAOYSA-N	-2	1	375.811	2.687	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl)C(F)F	ZINC000572043359	564579303	/nfs/dbraw/zinc/57/93/03/564579303.db2.gz	ZAORSULODSPYFJ-RXMQYKEDSA-N	-2	1	380.171	2.767	20	0		GFADML
Cc1c(C[S@@](C)=O)cccc1[N-]S(=O)(=O)c1cc(F)cc(C(=O)[O-])c1	ZINC000485301338	564612082	/nfs/dbraw/zinc/61/20/82/564612082.db2.gz	UWPXUQUINDIGMP-XMMPIXPASA-N	-2	1	385.438	2.512	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3nncs3)cc2)cc1	ZINC000559252635	564927597	/nfs/dbraw/zinc/92/75/97/564927597.db2.gz	FYKHKOHXFTZBBF-UHFFFAOYSA-N	-2	1	375.431	2.633	20	0		GFADML
O=C([O-])[C@@H](CCc1ccc(F)cc1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000560076346	564948519	/nfs/dbraw/zinc/94/85/19/564948519.db2.gz	CXFPQNIUYJTMRR-CQSZACIVSA-N	-2	1	389.807	2.983	20	0		GFADML
CCn1cc(S(=O)(=O)Nc2c(C)ccc(Cl)c2C(=O)[O-])cc1C(=O)[O-]	ZINC000504300103	565037442	/nfs/dbraw/zinc/03/74/42/565037442.db2.gz	UCKAIDXYXSYLGR-UHFFFAOYSA-N	-2	1	386.813	2.667	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2ccc(S[C@@H](C)C(=O)[O-])cc2)cn1	ZINC000504702107	565042812	/nfs/dbraw/zinc/04/28/12/565042812.db2.gz	DAGKXFFCNUYHAA-NSHDSACASA-N	-2	1	382.463	2.846	20	0		GFADML
CCC[C@@H](CCCC[N-]S(=O)(=O)c1c(F)cc(OC)cc1F)C(=O)[O-]	ZINC000669623298	565695285	/nfs/dbraw/zinc/69/52/85/565695285.db2.gz	HCGPIBKGHVSYTG-NSHDSACASA-N	-2	1	379.425	2.923	20	0		GFADML
COc1ccc(-c2cc3[n-]c(CN4CCC(C(=O)[O-])CC4)nc(=O)c3s2)cc1	ZINC000739876913	596922045	/nfs/dbraw/zinc/92/20/45/596922045.db2.gz	IYUGBPZFNBNWRU-UHFFFAOYSA-N	-2	1	399.472	2.957	20	0		GFADML
CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)cc1	ZINC000736847877	599853050	/nfs/dbraw/zinc/85/30/50/599853050.db2.gz	OXEFWUWXZQMDNJ-UHFFFAOYSA-N	-2	1	376.434	2.853	20	0		GFADML
CCC[C@@H]1CCCC[C@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736973921	599869484	/nfs/dbraw/zinc/86/94/84/599869484.db2.gz	KWGHXACFMISNOT-RDTXWAMCSA-N	-2	1	385.464	2.881	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(OCC(F)(F)F)nc1	ZINC000477400231	599905803	/nfs/dbraw/zinc/90/58/03/599905803.db2.gz	BYNZLSWADYABSW-UHFFFAOYSA-N	-2	1	390.339	2.830	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(CSCC(=O)[O-])c2)cc1OC	ZINC000738069911	599926182	/nfs/dbraw/zinc/92/61/82/599926182.db2.gz	PAKBLDBKCMDBAB-UHFFFAOYSA-N	-2	1	397.474	2.822	20	0		GFADML
COC(=O)c1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cccc([C@H](C)OC)c2)c1	ZINC000737654874	599981831	/nfs/dbraw/zinc/98/18/31/599981831.db2.gz	WPHVXJSFZIHJOB-NSHDSACASA-N	-2	1	393.417	2.680	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2ccc(F)c3ncccc23)c1	ZINC000511716199	600006176	/nfs/dbraw/zinc/00/61/76/600006176.db2.gz	RPYXRJNHMDBJIP-UHFFFAOYSA-N	-2	1	376.365	2.882	20	0		GFADML
Cc1cccc(C[C@H](C[N-]S(=O)(=O)c2cc(F)c(F)cc2F)C(=O)[O-])c1	ZINC000548228504	600095429	/nfs/dbraw/zinc/09/54/29/600095429.db2.gz	JKJOPBKQGZPBRE-GFCCVEGCSA-N	-2	1	387.379	2.634	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)c1C	ZINC000737713012	600300576	/nfs/dbraw/zinc/30/05/76/600300576.db2.gz	JRJPXMYRFJTJEO-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
COC(=O)NCc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000737636950	600302187	/nfs/dbraw/zinc/30/21/87/600302187.db2.gz	DSMNXETUQUHBOL-UHFFFAOYSA-N	-2	1	398.824	2.695	20	0		GFADML
O=C([O-])c1ccnc(NC(=O)c2ccc(S(=O)(=O)[N-]c3ccccc3)cc2)c1	ZINC000740244830	600431226	/nfs/dbraw/zinc/43/12/26/600431226.db2.gz	MKCRBAHYTXNXLJ-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@@H](C(=O)[O-])c1ccc(F)cc1	ZINC000737226225	600453763	/nfs/dbraw/zinc/45/37/63/600453763.db2.gz	GDGBVDNMDQXOOC-OAHLLOKOSA-N	-2	1	381.381	2.570	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1Cl	ZINC000498021077	600482358	/nfs/dbraw/zinc/48/23/58/600482358.db2.gz	ADZRTKDKVPLZOM-UHFFFAOYSA-N	-2	1	394.836	2.966	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc1	ZINC000481973189	600627629	/nfs/dbraw/zinc/62/76/29/600627629.db2.gz	LQFTYYXFBSPDEX-UHFFFAOYSA-N	-2	1	398.444	2.777	20	0		GFADML
O=C([O-])CCc1nnc([N-]C(=O)c2csc(Cc3ccccc3F)n2)s1	ZINC000739781164	600628775	/nfs/dbraw/zinc/62/87/75/600628775.db2.gz	IZWAYPUQDJBXAC-UHFFFAOYSA-N	-2	1	392.437	2.994	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cccc(Cl)c2C)ccc1C(=O)[O-]	ZINC000831327343	600687840	/nfs/dbraw/zinc/68/78/40/600687840.db2.gz	HWJAEDNARGKEDD-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)OC)c(C(=O)[O-])c2)c(C)c1	ZINC000830094561	600689130	/nfs/dbraw/zinc/68/91/30/600689130.db2.gz	MOMWEKZXQYMYNJ-UHFFFAOYSA-N	-2	1	393.417	2.679	20	0		GFADML
CCc1nnc(-c2ccc([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)cc2)o1	ZINC000481971240	600690248	/nfs/dbraw/zinc/69/02/48/600690248.db2.gz	GRAJVISDOGPLJX-UHFFFAOYSA-N	-2	1	387.417	2.727	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2ccc(NC(=O)OC(C)(C)C)cc2)cc1C(=O)[O-]	ZINC000264371392	600815435	/nfs/dbraw/zinc/81/54/35/600815435.db2.gz	LTMRAQJXWLGDJW-UHFFFAOYSA-N	-2	1	395.437	2.871	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)ccc1F	ZINC000736161476	600888441	/nfs/dbraw/zinc/88/84/41/600888441.db2.gz	VFSODMPJOYFZJM-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
Cc1noc(C)c1S(=O)(=O)[N-]c1cc(C(=O)[O-])c(F)cc1Br	ZINC000738944883	600898202	/nfs/dbraw/zinc/89/82/02/600898202.db2.gz	LBTUEEFEPMGSLL-UHFFFAOYSA-N	-2	1	393.190	2.692	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)cc1	ZINC000610111338	600899565	/nfs/dbraw/zinc/89/95/65/600899565.db2.gz	WOIBRXUIHDTMCI-UHFFFAOYSA-N	-2	1	377.418	2.636	20	0		GFADML
O=C([O-])CSCc1cccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)c1	ZINC000833263957	601224954	/nfs/dbraw/zinc/22/49/54/601224954.db2.gz	URQTVTOQPYBXFT-UHFFFAOYSA-N	-3	1	399.421	2.643	20	0		GFADML
O=C([O-])c1cc(Cl)cc([N-]S(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)c1	ZINC000833297107	601234472	/nfs/dbraw/zinc/23/44/72/601234472.db2.gz	DOZLVJALAACLOB-UHFFFAOYSA-N	-2	1	378.793	2.681	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)CCC(=O)[O-])cc2)c(C(=O)[O-])c1	ZINC000481445997	601249732	/nfs/dbraw/zinc/24/97/32/601249732.db2.gz	JQKGHEVNTZJYGB-UHFFFAOYSA-N	-3	1	391.401	2.542	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1C(=O)N(C)C	ZINC000832953007	601251032	/nfs/dbraw/zinc/25/10/32/601251032.db2.gz	UHZWVMHOLILEOT-YRNVUSSQSA-N	-2	1	388.445	2.595	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(Oc3cnccn3)c2)ccc1F	ZINC000032594884	601321703	/nfs/dbraw/zinc/32/17/03/601321703.db2.gz	HBFFEGUYECKPPU-UHFFFAOYSA-N	-2	1	389.364	2.907	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(OC)cc2C(=O)[O-])c1	ZINC000504643638	601327005	/nfs/dbraw/zinc/32/70/05/601327005.db2.gz	ZZVXGESYARJRLT-UHFFFAOYSA-N	-2	1	393.417	2.598	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](C(=O)[O-])c2ccc(Cl)cc2)c(F)c1	ZINC000832011170	601388262	/nfs/dbraw/zinc/38/82/62/601388262.db2.gz	RQIBZWYOTOEUGH-ZDUSSCGKSA-N	-2	1	391.779	2.731	20	0		GFADML
O=C([O-])[C@H]1CCCCN1C(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1	ZINC000262575304	601744631	/nfs/dbraw/zinc/74/46/31/601744631.db2.gz	OBXISSQJWVNGCV-QGZVFWFLSA-N	-2	1	388.445	2.567	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)OCCCO3)cc(F)c1F	ZINC000751141138	601831873	/nfs/dbraw/zinc/83/18/73/601831873.db2.gz	AVYGEBUTKHLYAA-UHFFFAOYSA-N	-2	1	385.344	2.625	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-c3csnn3)cc2)cc(F)c1F	ZINC000751145959	601836624	/nfs/dbraw/zinc/83/66/24/601836624.db2.gz	NPZLJFGAHOXDPN-UHFFFAOYSA-N	-2	1	397.384	2.982	20	0		GFADML
CN(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cc1	ZINC000830518843	601837693	/nfs/dbraw/zinc/83/76/93/601837693.db2.gz	ITQDOEPDQUPSPG-UHFFFAOYSA-N	-2	1	389.433	2.831	20	0		GFADML
CCn1ncc2ccc([N-]S(=O)(=O)c3cc(F)c(F)c(C(=O)[O-])c3)cc21	ZINC000175964573	601838071	/nfs/dbraw/zinc/83/80/71/601838071.db2.gz	FBNOIUQWAPZBNW-UHFFFAOYSA-N	-2	1	381.360	2.833	20	0		GFADML
CC(C)CC1CCN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CC1	ZINC000826840852	602231787	/nfs/dbraw/zinc/23/17/87/602231787.db2.gz	PRDXLHKGGYVONH-UHFFFAOYSA-N	-2	1	385.464	2.691	20	0		GFADML
C[C@H]1Cc2cc(S(=O)(=O)[N-]c3ccccc3CN(C)C(=O)[O-])ccc2O1	ZINC000739191143	602653812	/nfs/dbraw/zinc/65/38/12/602653812.db2.gz	RCJFPNIVBBXPDJ-LBPRGKRZSA-N	-2	1	376.434	2.921	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NCC[C@@H]2CCN(C(=O)[O-])C2)c([O-])c1	ZINC000738723955	602862594	/nfs/dbraw/zinc/86/25/94/602862594.db2.gz	UMGGZAHHXRLBLS-GFCCVEGCSA-N	-2	1	393.440	2.859	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NCC[C@H]2CCN(C(=O)[O-])C2)c([O-])c1	ZINC000738723957	602862756	/nfs/dbraw/zinc/86/27/56/602862756.db2.gz	UMGGZAHHXRLBLS-LBPRGKRZSA-N	-2	1	393.440	2.859	20	0		GFADML
Cc1cc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])ccc1N1C(=O)CCC1=O	ZINC000740090793	602865205	/nfs/dbraw/zinc/86/52/05/602865205.db2.gz	IWCQZIDIKNHTHJ-UHFFFAOYSA-N	-2	1	383.360	2.696	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(C)c(NC(C)=O)c2)ccc1NC(=O)[O-]	ZINC000739869959	603192531	/nfs/dbraw/zinc/19/25/31/603192531.db2.gz	QBSCJPHJEOZFPF-UHFFFAOYSA-N	-2	1	393.421	2.853	20	0		GFADML
CN(Cc1nccn1Cc1ccccc1)C(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000828427095	603934408	/nfs/dbraw/zinc/93/44/08/603934408.db2.gz	VVPALUXLZSGQDP-UHFFFAOYSA-N	-2	1	380.404	2.999	20	0		GFADML
CCC(=O)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)OC)c2)c1	ZINC000828580286	604806641	/nfs/dbraw/zinc/80/66/41/604806641.db2.gz	GCCQOFOBTJGVNG-UHFFFAOYSA-N	-2	1	391.401	2.565	20	0		GFADML
CC(=O)N(C)c1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000745978905	604990802	/nfs/dbraw/zinc/99/08/02/604990802.db2.gz	VGVNLYYLMOAAIF-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
CC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(C3(C(=O)[O-])CC3)cc2)cc1	ZINC000833388780	605123988	/nfs/dbraw/zinc/12/39/88/605123988.db2.gz	ZMNPOVNYNSCGHH-UHFFFAOYSA-N	-2	1	388.445	2.586	20	0		GFADML
CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])nc2)cc1	ZINC000833422086	605166625	/nfs/dbraw/zinc/16/66/25/605166625.db2.gz	WCWSDWHPQLGXNU-UHFFFAOYSA-N	-2	1	377.422	2.565	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CC[C@@](O)(Cc3cccc(Cl)c3)C2)c([O-])c1	ZINC000834259109	605400477	/nfs/dbraw/zinc/40/04/77/605400477.db2.gz	WDPFKKFWGOCAIK-LJQANCHMSA-N	-2	1	390.823	2.955	20	0		GFADML
O=C([O-])NCCCCC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000834234843	605902562	/nfs/dbraw/zinc/90/25/62/605902562.db2.gz	LIOAGTKIFGEXKO-UHFFFAOYSA-N	-2	1	391.449	2.864	20	0		GFADML
Cc1nc(NC(=O)[O-])sc1C(=O)OCc1cc(=O)oc2cc([O-])ccc12	ZINC000833914164	605952647	/nfs/dbraw/zinc/95/26/47/605952647.db2.gz	LSMZWJXSFZYDTL-UHFFFAOYSA-N	-2	1	376.346	2.710	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)c(Cl)c1	ZINC000822266597	606622335	/nfs/dbraw/zinc/62/23/35/606622335.db2.gz	DWQVVFZBHRIIJO-UHFFFAOYSA-N	-2	1	395.876	2.581	20	0		GFADML
CC(C)Sc1ccccc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)nc1	ZINC000820183670	607154968	/nfs/dbraw/zinc/15/49/68/607154968.db2.gz	IQUYXEBSQIOIQT-UHFFFAOYSA-N	-2	1	376.467	2.563	20	0		GFADML
Cc1nn(C)c(C)c1[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000275026329	655212212	/nfs/dbraw/zinc/21/22/12/655212212.db2.gz	DYTDBYBRCJDXMN-JTQLQIEISA-N	-2	1	398.293	2.509	20	0		GFADML
O=C([O-])[C@@H](C[C@@H]1CCOC1)[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000577356158	655457555	/nfs/dbraw/zinc/45/75/55/655457555.db2.gz	BTVGEYUPKNCPOK-GXSJLCMTSA-N	-2	1	389.882	2.713	20	0		GFADML
COc1cccc([N-]S(=O)(=O)c2cc(OC)c(C(=O)[O-])cc2Cl)c1F	ZINC000769888460	656297445	/nfs/dbraw/zinc/29/74/45/656297445.db2.gz	ASMGBROCSJXLTH-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)nc2C)c(C)c1OCC(=O)[O-]	ZINC000788495628	657730680	/nfs/dbraw/zinc/73/06/80/657730680.db2.gz	SRVUEKJWFOYGCF-UHFFFAOYSA-N	-2	1	384.841	2.924	20	0		GFADML
COc1c(F)cc([N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2C)cc1F	ZINC000793366522	658391157	/nfs/dbraw/zinc/39/11/57/658391157.db2.gz	ASVGFXYNBQPNOF-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
C[C@@H](O)c1cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)ccc1F	ZINC000795380394	658812636	/nfs/dbraw/zinc/81/26/36/658812636.db2.gz	LAUOVFNFCASUGA-SSDOTTSWSA-N	-2	1	375.324	2.656	20	0		GFADML
O=C([O-])c1cc(Br)c(S(=O)(=O)[N-]CCC2(F)CCC2)s1	ZINC000806567115	659836051	/nfs/dbraw/zinc/83/60/51/659836051.db2.gz	DRNSZTMTBPQHTP-UHFFFAOYSA-N	-2	1	386.264	2.769	20	0		GFADML
C[C@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])[C@@H](C)[C@H]1[N-]C(=O)C(F)(F)F	ZINC000809248336	659919698	/nfs/dbraw/zinc/91/96/98/659919698.db2.gz	DSCVKILZVGFFNM-RVBZMBCESA-N	-2	1	378.778	2.963	20	0		GFADML
O=C([O-])C1=CC[C@@H]([N-]S(=O)(=O)c2cc(Br)sc2Cl)C1	ZINC000853069384	661880628	/nfs/dbraw/zinc/88/06/28/661880628.db2.gz	ORQIDMLLBGMWPP-ZCFIWIBFSA-N	-2	1	386.676	2.616	20	0		GFADML
O=C([O-])CC[C@@H](C[N-]S(=O)(=O)c1cnc(Cl)c(Cl)c1)C(F)(F)F	ZINC000853071483	661880979	/nfs/dbraw/zinc/88/09/79/661880979.db2.gz	LLRHGKDHQWXMNF-LURJTMIESA-N	-2	1	395.186	2.710	20	0		GFADML
O=C([O-])CC[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)nc1Cl)C(F)(F)F	ZINC000853071604	661881018	/nfs/dbraw/zinc/88/10/18/661881018.db2.gz	OGRWTMFLSGUGBY-LURJTMIESA-N	-2	1	395.186	2.710	20	0		GFADML
CC(C)c1nn(C)cc1[N-]S(=O)(=O)c1c([O-])cccc1OC(F)(F)F	ZINC000901920250	663750933	/nfs/dbraw/zinc/75/09/33/663750933.db2.gz	AFXBPEFELRHDTB-UHFFFAOYSA-N	-2	1	379.360	2.949	20	0		GFADML
Cc1ncc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2Br)s1	ZINC000230096275	553064512	/nfs/dbraw/zinc/06/45/12/553064512.db2.gz	UMZXOBTWSIACLR-UHFFFAOYSA-N	-2	1	377.241	2.713	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000261676182	553155919	/nfs/dbraw/zinc/15/59/19/553155919.db2.gz	KZLWBUPZZCJTIH-ZETCQYMHSA-N	-2	1	376.681	2.552	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000261676176	553156051	/nfs/dbraw/zinc/15/60/51/553156051.db2.gz	KZLWBUPZZCJTIH-SSDOTTSWSA-N	-2	1	376.681	2.552	20	0		GFADML
COC(=O)c1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(C(=O)[O-])c1F	ZINC000427321112	563465233	/nfs/dbraw/zinc/46/52/33/563465233.db2.gz	ODGOHZHXEDOEKT-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(F)c(Br)c2)cc1O	ZINC000436647386	563676122	/nfs/dbraw/zinc/67/61/22/563676122.db2.gz	KAXXVUZPDNKLME-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
O=C(N[C@H]1C[C@@H]1C(F)F)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436776362	563679779	/nfs/dbraw/zinc/67/97/79/563679779.db2.gz	UOWBLPSYSNQFCG-QWRGUYRKSA-N	-2	1	388.417	2.638	20	0		GFADML
CC[C@@H](C)CONC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000293815448	563824706	/nfs/dbraw/zinc/82/47/06/563824706.db2.gz	UPEVBAUPZBFEGU-LLVKDONJSA-N	-2	1	384.479	2.962	20	0		GFADML
C[C@H](Sc1ccc(NS(=O)(=O)c2csc(C(=O)[O-])c2)cc1)C(=O)[O-]	ZINC000507608802	564234466	/nfs/dbraw/zinc/23/44/66/564234466.db2.gz	XTVLZSYCBZKFJF-QMMMGPOBSA-N	-2	1	387.460	2.812	20	0		GFADML
O=C(NC[C@H]1CC12CC2)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000565881772	564300954	/nfs/dbraw/zinc/30/09/54/564300954.db2.gz	SOLOKDSNHLMAAU-LLVKDONJSA-N	-2	1	378.475	2.784	20	0		GFADML
CC[C@H](CC[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000568363370	564415817	/nfs/dbraw/zinc/41/58/17/564415817.db2.gz	DCAPKTXGSITMJV-SSDOTTSWSA-N	-2	1	386.214	2.507	20	0		GFADML
O=C([O-])CC[N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl	ZINC000479207083	564430898	/nfs/dbraw/zinc/43/08/98/564430898.db2.gz	QKPABLNIFIFERV-UHFFFAOYSA-N	-2	1	377.043	2.509	20	0		GFADML
Cc1cccc([C@H]([N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C(=O)[O-])c1	ZINC000547548440	564493536	/nfs/dbraw/zinc/49/35/36/564493536.db2.gz	JJKMAUCCFYUGCU-ZDUSSCGKSA-N	-2	1	384.797	2.661	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)cc1F	ZINC000517159622	564526490	/nfs/dbraw/zinc/52/64/90/564526490.db2.gz	ZEPHXWZDURWWCM-UHFFFAOYSA-N	-2	1	389.426	2.720	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1ccc(Cl)c(F)c1	ZINC000548260941	564544514	/nfs/dbraw/zinc/54/45/14/564544514.db2.gz	YAEFCPIQFJQDTN-LBPRGKRZSA-N	-2	1	379.743	2.862	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cc(Cl)sc1Cl)Oc1ccccc1	ZINC000549937331	564609721	/nfs/dbraw/zinc/60/97/21/564609721.db2.gz	QVBPPYLJVIXANY-VIFPVBQESA-N	-2	1	396.273	2.865	20	0		GFADML
Cc1cc(C(=O)N[C@@H]2CCc3sc(Cl)cc32)[n-]c2nc(=O)[n-]c(=O)c1-2	ZINC000522050661	564643361	/nfs/dbraw/zinc/64/33/61/564643361.db2.gz	LAFDJYUGOIXUOK-MRVPVSSYSA-N	-2	1	376.825	2.877	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)Nc2cc(F)c(F)cc2C(=O)[O-])c(Cl)c1	ZINC000489692860	564749380	/nfs/dbraw/zinc/74/93/80/564749380.db2.gz	BTMPRZVHHPBSGT-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
O=C([O-])c1cccc([N-]S(=O)(=O)Cc2ccccc2Br)c1O	ZINC000554430240	564760597	/nfs/dbraw/zinc/76/05/97/564760597.db2.gz	GEZXHXPHGSESSX-UHFFFAOYSA-N	-2	1	386.223	2.795	20	0		GFADML
CCC[C@H](CCCC[N-]S(=O)(=O)c1ccc(Br)o1)C(=O)[O-]	ZINC000555955235	564809451	/nfs/dbraw/zinc/80/94/51/564809451.db2.gz	XYEKGMQCFZZEQG-SNVBAGLBSA-N	-2	1	382.276	2.992	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1cccc(Cl)c1Cl)C(F)(F)F	ZINC000560417490	564961000	/nfs/dbraw/zinc/96/10/00/564961000.db2.gz	ZKRQXYIBWITGNU-LURJTMIESA-N	-2	1	380.171	2.925	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cc(F)cc(Cl)c2)c(C(=O)[O-])cc1OC	ZINC000533689018	564970353	/nfs/dbraw/zinc/97/03/53/564970353.db2.gz	CJQJBMIAXQYWAP-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])c1	ZINC000610192398	566070438	/nfs/dbraw/zinc/07/04/38/566070438.db2.gz	WZDNJNCPRSTUOK-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2cccs2)c(F)c1	ZINC000681559228	566111824	/nfs/dbraw/zinc/11/18/24/566111824.db2.gz	YBNGFYCOEOIOPQ-LLVKDONJSA-N	-2	1	377.390	2.529	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NCCCC(=O)[O-])cc2)cc1C	ZINC000262566386	597279893	/nfs/dbraw/zinc/27/98/93/597279893.db2.gz	BJRVGAAFRFDANQ-UHFFFAOYSA-N	-2	1	390.461	2.699	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccccc2CC(=O)[O-])cc(C(=O)[O-])c1Cl	ZINC000821046197	597420514	/nfs/dbraw/zinc/42/05/14/597420514.db2.gz	ZRWHXZZNBWXNHZ-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
CC[C@H](C)[C@H](C)N(C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CC1	ZINC000736870241	599774806	/nfs/dbraw/zinc/77/48/06/599774806.db2.gz	KAXQKBQTAKKMIN-KBPBESRZSA-N	-2	1	385.464	2.832	20	0		GFADML
CCc1cc2c(COC(=O)c3cccc(OCC(=O)[O-])c3)cc(=O)oc2cc1[O-]	ZINC000737252962	599882489	/nfs/dbraw/zinc/88/24/89/599882489.db2.gz	ZEKXFHACILMWQA-UHFFFAOYSA-N	-2	1	398.367	2.881	20	0		GFADML
COC(=O)CSCc1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)c1	ZINC000485072063	599926445	/nfs/dbraw/zinc/92/64/45/599926445.db2.gz	INWMBXGPVWCYRN-UHFFFAOYSA-N	-2	1	395.458	2.592	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)N[C@@H](CCC(=O)[O-])c1ccccc1	ZINC000738873895	599952589	/nfs/dbraw/zinc/95/25/89/599952589.db2.gz	FILGZNJIOHNPBA-KRWDZBQOSA-N	-2	1	396.447	2.707	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1	ZINC000737076518	600025393	/nfs/dbraw/zinc/02/53/93/600025393.db2.gz	RGFAXSJRRMLBCS-UHFFFAOYSA-N	-2	1	396.852	2.688	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(NC(=O)[C@H]3C[C@@H]3C(=O)[O-])ccc2C)c1	ZINC000262592754	600102805	/nfs/dbraw/zinc/10/28/05/600102805.db2.gz	IEJYVPXGIYOTGZ-HOTGVXAUSA-N	-2	1	388.445	2.763	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2N2CCCC2)cc1	ZINC000738063999	600103650	/nfs/dbraw/zinc/10/36/50/600103650.db2.gz	OFMFWCGPUSZFDO-UHFFFAOYSA-N	-2	1	376.434	2.794	20	0		GFADML
CC[C@H](C)[C@H]1CCCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736880127	600409455	/nfs/dbraw/zinc/40/94/55/600409455.db2.gz	LMZFRJVXDMLORG-KBXCAEBGSA-N	-2	1	385.464	2.834	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)[O-])ccc1OC	ZINC000563583528	600541978	/nfs/dbraw/zinc/54/19/78/600541978.db2.gz	ZEAFKFBSQOKTIV-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
CC(C)NC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000481968794	600627135	/nfs/dbraw/zinc/62/71/35/600627135.db2.gz	VIWPKHWBADIPJV-UHFFFAOYSA-N	-2	1	391.449	2.644	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000736232740	600678612	/nfs/dbraw/zinc/67/86/12/600678612.db2.gz	LPFJUABMVMTQFY-UHFFFAOYSA-N	-3	1	381.381	2.687	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)cc1C(=O)[O-]	ZINC000831435451	600690240	/nfs/dbraw/zinc/69/02/40/600690240.db2.gz	XODRUXLDXFWFPD-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NC(C)C)cc2)cc1C(=O)[O-]	ZINC000048382808	600811504	/nfs/dbraw/zinc/81/15/04/600811504.db2.gz	MRHHIZNUVHZUGM-UHFFFAOYSA-N	-2	1	376.434	2.632	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(N(C)C(=O)[O-])cc2)ccc1C	ZINC000831348451	600814145	/nfs/dbraw/zinc/81/41/45/600814145.db2.gz	OIDOGMNCKDHQPU-UHFFFAOYSA-N	-2	1	378.406	2.697	20	0		GFADML
CCN(CC)C(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)cc1	ZINC000284925757	600886497	/nfs/dbraw/zinc/88/64/97/600886497.db2.gz	AEZHLUFCBLFIDR-UHFFFAOYSA-N	-2	1	390.461	2.976	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3ccc(/C=C/C(=O)[O-])cc3)ccc2o1	ZINC000831831581	601230058	/nfs/dbraw/zinc/23/00/58/601230058.db2.gz	MHEXFGXRNJJZBN-RUDMXATFSA-N	-2	1	388.401	2.873	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3ccc(C(=O)[O-])cc3C)ccc2o1	ZINC000831831638	601230380	/nfs/dbraw/zinc/23/03/80/601230380.db2.gz	NXQLLUXTYCMURS-UHFFFAOYSA-N	-2	1	376.390	2.782	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1C(=O)N(C)C	ZINC000267507539	601250654	/nfs/dbraw/zinc/25/06/54/601250654.db2.gz	OMDDZMUJHVSZAJ-UHFFFAOYSA-N	-2	1	390.461	2.813	20	0		GFADML
CCc1nc(C2([N-]S(=O)(=O)c3cc(C(=O)[O-])ccc3Cl)CCCC2)no1	ZINC000830309683	601265556	/nfs/dbraw/zinc/26/55/56/601265556.db2.gz	MYPWWPFBYYFSRA-UHFFFAOYSA-N	-2	1	399.856	2.731	20	0		GFADML
CCn1cnnc1-c1cccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000032096162	601321352	/nfs/dbraw/zinc/32/13/52/601321352.db2.gz	NJZMAKZZQQCQSZ-UHFFFAOYSA-N	-2	1	390.396	2.603	20	0		GFADML
COc1cc(C(=O)[O-])cc([N-]S(=O)(=O)/C=C/c2ccc(F)cc2)c1OC	ZINC000751142615	601333040	/nfs/dbraw/zinc/33/30/40/601333040.db2.gz	NNCGOSQZKGTUQX-BQYQJAHWSA-N	-2	1	381.381	2.954	20	0		GFADML
CCc1cccc(C)c1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000830260230	601449923	/nfs/dbraw/zinc/44/99/23/601449923.db2.gz	YEKIFVLTTRKLQZ-UHFFFAOYSA-N	-2	1	379.416	2.916	20	0		GFADML
COc1ccc(CCC(=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1C	ZINC000532292515	601488310	/nfs/dbraw/zinc/48/83/10/601488310.db2.gz	ZKPVGLJTLSIYDI-UHFFFAOYSA-N	-2	1	393.417	2.520	20	0		GFADML
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)[N-]S(=O)(=O)c1cc2ccccc2o1	ZINC000548207252	601562328	/nfs/dbraw/zinc/56/23/28/601562328.db2.gz	MERPNKBVGYLJHJ-MRXNPFEDSA-N	-2	1	384.413	2.888	20	0		GFADML
COc1cc(C(=O)[O-])sc1S(=O)(=O)[N-]c1cc(-c2ccccc2)n[nH]1	ZINC000831939591	601605578	/nfs/dbraw/zinc/60/55/78/601605578.db2.gz	QPFHIPFARFFOMF-UHFFFAOYSA-N	-2	1	379.419	2.646	20	0		GFADML
CC(C)CC1(CNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CCC1	ZINC000826826461	601689535	/nfs/dbraw/zinc/68/95/35/601689535.db2.gz	IVMJDEHZMVUELZ-UHFFFAOYSA-N	-2	1	385.464	2.739	20	0		GFADML
CC[C@H](NC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2cccc(C)c2)c1)C(=O)[O-]	ZINC000262540748	601752097	/nfs/dbraw/zinc/75/20/97/601752097.db2.gz	VAMWMKYEGLEEIA-INIZCTEOSA-N	-2	1	390.461	2.697	20	0		GFADML
Cn1cc([N-]S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)cc1C(=O)[O-]	ZINC000833052821	601785070	/nfs/dbraw/zinc/78/50/70/601785070.db2.gz	KWXMTJOLSKKADO-UHFFFAOYSA-N	-2	1	380.756	2.779	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C)c2)cc(F)c1F	ZINC000755976307	601840766	/nfs/dbraw/zinc/84/07/66/601840766.db2.gz	XBRBMNAUJGDXDQ-UHFFFAOYSA-N	-2	1	385.344	2.559	20	0		GFADML
Cc1cnc([C@H](C)[N-]S(=O)(=O)c2cc(C(=O)[O-])oc2Br)s1	ZINC000123707549	602162693	/nfs/dbraw/zinc/16/26/93/602162693.db2.gz	GAAFMRZAIUFMSV-LURJTMIESA-N	-2	1	395.256	2.545	20	0		GFADML
O=C([O-])c1csc(S(=O)(=O)[N-]c2cc(CCc3ccccc3)n[nH]2)c1	ZINC000833344270	602307230	/nfs/dbraw/zinc/30/72/30/602307230.db2.gz	JGCKPJQKSKZESX-UHFFFAOYSA-N	-2	1	377.447	2.755	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)cc1	ZINC000754759304	602322637	/nfs/dbraw/zinc/32/26/37/602322637.db2.gz	LARGDFCMUWWUDK-UHFFFAOYSA-N	-2	1	381.381	2.892	20	0		GFADML
CCN(Cc1ccccc1NC(=O)Cc1c(C)nc2cc(=O)[n-]n2c1C)C(=O)[O-]	ZINC000739445007	602449186	/nfs/dbraw/zinc/44/91/86/602449186.db2.gz	REYMKQIABHFNGE-UHFFFAOYSA-N	-2	1	397.435	2.733	20	0		GFADML
COc1ccc(NC(=O)c2ccc(F)c(NC(=O)[O-])c2)cc1[N-]S(C)(=O)=O	ZINC000739923789	602497059	/nfs/dbraw/zinc/49/70/59/602497059.db2.gz	KXEHFYSTGABBAQ-UHFFFAOYSA-N	-2	1	397.384	2.548	20	0		GFADML
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])cc3)cc2C[C@@H]1C	ZINC000738536783	602646069	/nfs/dbraw/zinc/64/60/69/602646069.db2.gz	IAVQRUJFGIJUSH-NSHDSACASA-N	-2	1	389.433	2.875	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C[C@H](C)N1C(=O)OC(C)(C)C	ZINC000739169505	602864252	/nfs/dbraw/zinc/86/42/52/602864252.db2.gz	QDPSSRWAVDBOCA-RYUDHWBXSA-N	-2	1	393.440	2.952	20	0		GFADML
COc1cccc(N2CCC[C@H](NC(=O)c3ccc(NC(=O)[O-])cc3[O-])C2)c1	ZINC000739954207	602867399	/nfs/dbraw/zinc/86/73/99/602867399.db2.gz	WWURMKCTHHYEFK-AWEZNQCLSA-N	-2	1	385.420	2.890	20	0		GFADML
CC(C)[C@H](NC(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000736376940	603233547	/nfs/dbraw/zinc/23/35/47/603233547.db2.gz	QHDUKCYTYNRWHN-INIZCTEOSA-N	-2	1	391.449	2.718	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)c1	ZINC000828799793	603401454	/nfs/dbraw/zinc/40/14/54/603401454.db2.gz	ROQVVYDKMBXVGD-LLVKDONJSA-N	-2	1	378.406	2.603	20	0		GFADML
CCOC(=O)c1cccc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)c1	ZINC000827350355	603403274	/nfs/dbraw/zinc/40/32/74/603403274.db2.gz	TXRYRMQSAIROKH-GFCCVEGCSA-N	-2	1	392.433	2.993	20	0		GFADML
C[C@@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1nc(Cc2ccccc2)no1	ZINC000825464880	603841016	/nfs/dbraw/zinc/84/10/16/603841016.db2.gz	GESPWNHZIALISX-LLVKDONJSA-N	-2	1	382.376	2.947	20	0		GFADML
CCC[C@H](C)[C@H]1CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829208091	604342373	/nfs/dbraw/zinc/34/23/73/604342373.db2.gz	IKQJLFKTFMZTJO-KBXCAEBGSA-N	-2	1	385.464	2.834	20	0		GFADML
CC(=O)N1CCCc2cc([N-]S(=O)(=O)c3ccc(F)cc3C(=O)[O-])ccc21	ZINC000833393359	604744491	/nfs/dbraw/zinc/74/44/91/604744491.db2.gz	JSXOHEXCWXNSEP-UHFFFAOYSA-N	-2	1	392.408	2.624	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(F)cc2C(=O)[O-])cc1	ZINC000833418772	604745021	/nfs/dbraw/zinc/74/50/21/604745021.db2.gz	NRTDZEBHWAJOGY-UHFFFAOYSA-N	-3	1	381.381	2.687	20	0		GFADML
O=C([O-])CSCc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(F)c2)c1	ZINC000833264133	604768670	/nfs/dbraw/zinc/76/86/70/604768670.db2.gz	YHMSMGJEIKEXRU-UHFFFAOYSA-N	-3	1	399.421	2.643	20	0		GFADML
O=C([O-])COc1ccc([N-]S(=O)(=O)c2ccc(F)c(F)c2)cc1Cl	ZINC000833259435	604807568	/nfs/dbraw/zinc/80/75/68/604807568.db2.gz	OMHVQKGEJFDYBO-UHFFFAOYSA-N	-2	1	377.752	2.882	20	0		GFADML
CC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(OCC(=O)[O-])c(Cl)c2)cc1	ZINC000825957120	604808420	/nfs/dbraw/zinc/80/84/20/604808420.db2.gz	LOHUIXMUVRHCOO-UHFFFAOYSA-N	-2	1	383.809	2.807	20	0		GFADML
O=C([O-])CC1([N-]S(=O)(=O)c2cc(Br)sc2Cl)CCC1	ZINC000833205752	604811281	/nfs/dbraw/zinc/81/12/81/604811281.db2.gz	HONXZVWVRIFPGG-UHFFFAOYSA-N	-2	1	388.692	2.840	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2OC)c(C)c1	ZINC000833662307	604861117	/nfs/dbraw/zinc/86/11/17/604861117.db2.gz	BEPQCKKUYRKFOI-UHFFFAOYSA-N	-2	1	395.433	2.910	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(Cl)cc2C(=O)[O-])ccc1NC(C)=O	ZINC000833730094	605168181	/nfs/dbraw/zinc/16/81/81/605168181.db2.gz	VGZAPLJXFSYMTP-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
CC(=O)N1CCc2cc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])c(F)c3)ccc21	ZINC000833390656	605263925	/nfs/dbraw/zinc/26/39/25/605263925.db2.gz	CWDXZULIZBUTIG-UHFFFAOYSA-N	-2	1	393.396	2.625	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2cccn(Cc3ccccc3)c2=O)c([O-])c1	ZINC000834255251	605655950	/nfs/dbraw/zinc/65/59/50/605655950.db2.gz	GPZYXKGYFBNWJF-UHFFFAOYSA-N	-2	1	379.372	2.944	20	0		GFADML
O=C([O-])N1CCC2(C[C@H]2C(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)CC1	ZINC000834288848	605822563	/nfs/dbraw/zinc/82/25/63/605822563.db2.gz	ZKVSSWMKITVKOP-KRWDZBQOSA-N	-2	1	386.448	2.594	20	0		GFADML
CC(C)(C)n1cc(-c2nn[n-]n2)c([N-]S(=O)(=O)c2ccc3ccccc3c2)n1	ZINC000819971837	606621034	/nfs/dbraw/zinc/62/10/34/606621034.db2.gz	UCVOYEHJPKRJGP-UHFFFAOYSA-N	-2	1	397.464	2.772	20	0		GFADML
O=S(=O)([N-]c1ncc(-c2nn[n-]n2)s1)c1csc2ccc(Cl)cc21	ZINC000823588927	607026796	/nfs/dbraw/zinc/02/67/96/607026796.db2.gz	FUGCHHHSGSYRLQ-UHFFFAOYSA-N	-2	1	398.882	2.992	20	0		GFADML
CC[C@H](C)[C@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000261704832	655441875	/nfs/dbraw/zinc/44/18/75/655441875.db2.gz	OSYBIOXACGZEFB-XNCJUZBTSA-N	-2	1	390.708	2.942	20	0		GFADML
O=C([O-])c1c(F)cc([N-]S(=O)(=O)CCOc2ccc(F)cc2)cc1F	ZINC000742231989	655712670	/nfs/dbraw/zinc/71/26/70/655712670.db2.gz	NAHKWCVRADDNFR-UHFFFAOYSA-N	-2	1	375.324	2.623	20	0		GFADML
CS(=O)(=O)[N-]c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)nc1Cl	ZINC000751271020	655824427	/nfs/dbraw/zinc/82/44/27/655824427.db2.gz	XLCQKMKNZWLSGK-UHFFFAOYSA-N	-2	1	396.277	2.561	20	0		GFADML
O=C([O-])c1c(F)cccc1[N-]S(=O)(=O)c1ccc2nc(Cl)cnc2c1	ZINC000759705383	655961524	/nfs/dbraw/zinc/96/15/24/655961524.db2.gz	GXHZBZSCFKSYQF-UHFFFAOYSA-N	-2	1	381.772	2.921	20	0		GFADML
CS(=O)(=O)[N-]c1ccccc1[N-]S(=O)(=O)c1c(Cl)ccnc1Cl	ZINC000766895291	656187531	/nfs/dbraw/zinc/18/75/31/656187531.db2.gz	DIERYYFSGWMUMN-UHFFFAOYSA-N	-2	1	396.277	2.561	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)cc1	ZINC000767735159	656217522	/nfs/dbraw/zinc/21/75/22/656217522.db2.gz	LCDIUHMOLKRHEI-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1ccc(Br)o1)CC1CCCC1	ZINC000776553090	656756718	/nfs/dbraw/zinc/75/67/18/656756718.db2.gz	QQWXXRKWFRJKTL-SNVBAGLBSA-N	-2	1	380.260	2.602	20	0		GFADML
C[C@@H](CC[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000776587988	656763677	/nfs/dbraw/zinc/76/36/77/656763677.db2.gz	BWKKWTLUUKZLSE-YFKPBYRVSA-N	-2	1	376.681	2.553	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc3c2COC3=O)cc(Cl)c1F	ZINC000808128156	659879553	/nfs/dbraw/zinc/87/95/53/659879553.db2.gz	HHUQOEYGRIHFKZ-UHFFFAOYSA-N	-2	1	385.756	2.649	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc2c1COC2=O	ZINC000808128150	659879605	/nfs/dbraw/zinc/87/96/05/659879605.db2.gz	HBMXPOVZHMLEEL-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
O=C(NOC/C=C\Cl)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000812405949	660026661	/nfs/dbraw/zinc/02/66/61/660026661.db2.gz	LGJSLPGOOUVJPV-KXFIGUGUSA-N	-2	1	388.854	2.668	20	0		GFADML
Cc1ccc(CN2CCC[C@@H]([N-]C(=O)C(F)(F)F)[C@@H]2C(=O)[O-])c(Cl)c1	ZINC000852733675	661872474	/nfs/dbraw/zinc/87/24/74/661872474.db2.gz	WDCWMZKWKYEXQM-CHWSQXEVSA-N	-2	1	378.778	2.745	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@H]([N-]S(=O)(=O)c1cc3ccccc3o1)CCS2	ZINC000899948093	663703440	/nfs/dbraw/zinc/70/34/40/663703440.db2.gz	FBMKPRUUOYKNGF-UIORMTCPSA-N	-2	1	381.475	2.840	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2cccc(Br)c2)c1	ZINC000143264934	551395450	/nfs/dbraw/zinc/39/54/50/551395450.db2.gz	ALPSVIQFSKPZMT-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COc1cc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)ccc1C(=O)[O-]	ZINC000432779091	563593260	/nfs/dbraw/zinc/59/32/60/563593260.db2.gz	JCMWDQPPTQYOSE-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
Cc1nnc(NC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])s1	ZINC000436567185	563674690	/nfs/dbraw/zinc/67/46/90/563674690.db2.gz	ZIKYSQWTTKDKGL-UHFFFAOYSA-N	-2	1	396.475	2.667	20	0		GFADML
CC(C)(C)c1nnc(C[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)s1	ZINC000565060322	564264623	/nfs/dbraw/zinc/26/46/23/564264623.db2.gz	AHPDAICSRNBVFG-UHFFFAOYSA-N	-2	1	389.886	2.666	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(N(C)C)cc2C(=O)[O-])c(Cl)c1	ZINC000566702906	564339190	/nfs/dbraw/zinc/33/91/90/564339190.db2.gz	MKIHNHGRXXCQID-UHFFFAOYSA-N	-2	1	384.841	2.914	20	0		GFADML
CCCC1CCC(NS(=O)(=O)c2ccc([N-]S(C)(=O)=O)cc2F)CC1	ZINC000477151798	564367333	/nfs/dbraw/zinc/36/73/33/564367333.db2.gz	RFPKKKGFPCNYTQ-UHFFFAOYSA-N	-2	1	392.518	2.834	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1C[S@](C)=O	ZINC000546538914	564458540	/nfs/dbraw/zinc/45/85/40/564458540.db2.gz	RFIWDXDIEQCOBZ-DEOSSOPVSA-N	-2	1	381.475	2.627	20	0		GFADML
CN(C)c1ccc([N-]S(=O)(=O)c2cnc3ccsc3c2)c(C(=O)[O-])c1	ZINC000547878644	564515367	/nfs/dbraw/zinc/51/53/67/564515367.db2.gz	WOISAAKAKUDZRX-UHFFFAOYSA-N	-2	1	377.447	2.861	20	0		GFADML
O=C([O-])[C@H]1CCCCCC[C@H]1[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000547934791	564523907	/nfs/dbraw/zinc/52/39/07/564523907.db2.gz	JBYUSZPGNXIPDL-VHSXEESVSA-N	-2	1	380.260	2.744	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl)C(=O)[O-]	ZINC000570874885	564525223	/nfs/dbraw/zinc/52/52/23/564525223.db2.gz	UWMSKDCPGDFIAL-LURJTMIESA-N	-2	1	391.070	2.897	20	0		GFADML
C[C@@]1(C(=O)[O-])CCC[C@@H]1[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000548216562	564537691	/nfs/dbraw/zinc/53/76/91/564537691.db2.gz	HNVMEXHJZIXJHX-WCQYABFASA-N	-2	1	398.225	2.649	20	0		GFADML
C[C@@H](CC[N-]S(=O)(=O)c1cc(Br)sc1Cl)CC(=O)[O-]	ZINC000548231388	564539983	/nfs/dbraw/zinc/53/99/83/564539983.db2.gz	FKIXPVYPUKYRFM-LURJTMIESA-N	-2	1	390.708	2.943	20	0		GFADML
O=C([O-])[C@@H](Cc1c(F)cccc1Cl)[N-]S(=O)(=O)c1cccc(F)c1F	ZINC000548262877	564544810	/nfs/dbraw/zinc/54/48/10/564544810.db2.gz	DXCOOLVEPPNGPB-GFCCVEGCSA-N	-2	1	393.770	2.732	20	0		GFADML
O=C([O-])c1cc(F)cc(S(=O)(=O)[N-]c2ccc(-c3csnn3)cc2)c1	ZINC000485277142	564611572	/nfs/dbraw/zinc/61/15/72/564611572.db2.gz	WTMYEXRRCXWYAF-UHFFFAOYSA-N	-2	1	379.394	2.843	20	0		GFADML
C[C@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F	ZINC000530459833	564883056	/nfs/dbraw/zinc/88/30/56/564883056.db2.gz	QKKUZRIRYNKXRH-ZCFIWIBFSA-N	-2	1	388.642	2.773	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1c(Cl)cccc1Cl)C(F)(F)F	ZINC000560421058	564960766	/nfs/dbraw/zinc/96/07/66/564960766.db2.gz	XCEHIEBWQMJREX-LURJTMIESA-N	-2	1	380.171	2.925	20	0		GFADML
O=C([O-])c1cc2c(cc1[N-]S(=O)(=O)c1cc(F)cc(Cl)c1)OCCO2	ZINC000535892725	565023644	/nfs/dbraw/zinc/02/36/44/565023644.db2.gz	LTZZWIGPWOYDEN-UHFFFAOYSA-N	-2	1	387.772	2.749	20	0		GFADML
COc1ccc(Cl)c(C(=O)[O-])c1NS(=O)(=O)c1ccc(C(=O)[O-])cc1	ZINC000505127668	565049558	/nfs/dbraw/zinc/04/95/58/565049558.db2.gz	FEIWZBYIJBBAPF-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(Cl)c1	ZINC000591681315	565236422	/nfs/dbraw/zinc/23/64/22/565236422.db2.gz	JDOZLGMWQKKRKO-UHFFFAOYSA-N	-3	1	375.811	2.907	20	0		GFADML
C[C@@H](CSCC[N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000592447920	565276435	/nfs/dbraw/zinc/27/64/35/565276435.db2.gz	IEBCHBHVQVMDHN-LURJTMIESA-N	-2	1	378.324	2.787	20	0		GFADML
C[C@@H](CSCC[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Cl)C(=O)[O-]	ZINC000593273314	565322910	/nfs/dbraw/zinc/32/29/10/565322910.db2.gz	HCLLEEZYPXZUBL-ZETCQYMHSA-N	-2	1	390.285	2.865	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N(C)CCC(=O)[O-])cc2)cc1C	ZINC000262400194	597010368	/nfs/dbraw/zinc/01/03/68/597010368.db2.gz	ASBXSZTUJPFZNX-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)N[C@@H](C(=O)[O-])C(C)C)cc1	ZINC000262072239	597189530	/nfs/dbraw/zinc/18/95/30/597189530.db2.gz	CODHEIDGBNUCPW-QGZVFWFLSA-N	-2	1	390.461	2.635	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)NCCCC(=O)[O-])c1	ZINC000262611168	597274706	/nfs/dbraw/zinc/27/47/06/597274706.db2.gz	LEHWCYMMPICHSO-UHFFFAOYSA-N	-2	1	390.461	2.699	20	0		GFADML
CC(C)N(CC(=O)[O-])C(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-]	ZINC000820006529	598149166	/nfs/dbraw/zinc/14/91/66/598149166.db2.gz	RDJMYQDLMCJVKE-UHFFFAOYSA-N	-2	1	392.358	2.858	20	0		GFADML
O=C([O-])[C@@H](CNC(=O)c1cc(Br)ccc1[O-])Cc1ccc(O)cc1	ZINC000739396626	599717102	/nfs/dbraw/zinc/71/71/02/599717102.db2.gz	IMIUSDJQCCXSEB-LLVKDONJSA-N	-2	1	394.221	2.534	20	0		GFADML
CCOc1ccc(C[C@@H](C[N-]S(=O)(=O)c2cccc(F)c2F)C(=O)[O-])cc1	ZINC000737205310	599730118	/nfs/dbraw/zinc/73/01/18/599730118.db2.gz	IMRWATFPWNAZKW-ZDUSSCGKSA-N	-2	1	399.415	2.585	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3nc([C@@H]4CCCO4)[nH]c3c2)o1	ZINC000740187456	599738985	/nfs/dbraw/zinc/73/89/85/599738985.db2.gz	LLVZFKIZFAHLER-LBPRGKRZSA-N	-2	1	377.378	2.506	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000727795501	599765595	/nfs/dbraw/zinc/76/55/95/599765595.db2.gz	JYNIVGHRCGAXHZ-UHFFFAOYSA-N	-2	1	381.381	2.892	20	0		GFADML
CSc1nc(C)c(CCC(=O)Nc2ccc(CCC(=O)[O-])cc2)c(=O)[n-]1	ZINC000738211270	599768471	/nfs/dbraw/zinc/76/84/71/599768471.db2.gz	UNEOWTNREWSZDR-UHFFFAOYSA-N	-2	1	375.450	2.801	20	0		GFADML
C[C@@H](CNC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1)C(=O)[O-]	ZINC000736605543	599780817	/nfs/dbraw/zinc/78/08/17/599780817.db2.gz	IGBMZWYKWHIJTR-NSHDSACASA-N	-2	1	396.852	2.591	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c(C(=O)[O-])s1	ZINC000737680002	599813968	/nfs/dbraw/zinc/81/39/68/599813968.db2.gz	FUWAXARNJKBGJW-UHFFFAOYSA-N	-2	1	393.801	2.826	20	0		GFADML
CN(C(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)cc2)cc1)C(C)(C)C(=O)[O-]	ZINC000485366853	600171954	/nfs/dbraw/zinc/17/19/54/600171954.db2.gz	PFPCMTSQYIDUMI-UHFFFAOYSA-N	-2	1	394.424	2.562	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(-n2ccnc2)c(F)c1	ZINC000740143154	600473188	/nfs/dbraw/zinc/47/31/88/600473188.db2.gz	FEAAAILTXRQFBY-UHFFFAOYSA-N	-2	1	379.344	2.650	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2N(C)C)cc1C(=O)[O-]	ZINC000042791743	600542036	/nfs/dbraw/zinc/54/20/36/600542036.db2.gz	KBBGJRYGBWYMNA-UHFFFAOYSA-N	-2	1	384.841	2.914	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccccc2-c2noc(C)n2)cc1C(=O)[O-]	ZINC000372621450	600542624	/nfs/dbraw/zinc/54/26/24/600542624.db2.gz	UUQRPAUOBRFZKC-UHFFFAOYSA-N	-2	1	389.389	2.553	20	0		GFADML
Cc1[nH]c(C(=O)CSc2nc(C(F)(F)F)cc(=O)[n-]2)c(C)c1C(=O)[O-]	ZINC000738156422	600582551	/nfs/dbraw/zinc/58/25/51/600582551.db2.gz	VOZHHRRGQABKLJ-UHFFFAOYSA-N	-2	1	375.328	2.819	20	0		GFADML
COCCOc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000327517077	600637445	/nfs/dbraw/zinc/63/74/45/600637445.db2.gz	QFLBGSXZGMLANA-UHFFFAOYSA-N	-2	1	385.825	2.864	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc3ncccc3c2)ccc1C(=O)[O-]	ZINC000831327731	600689370	/nfs/dbraw/zinc/68/93/70/600689370.db2.gz	MXBIMEDKGGFDSJ-UHFFFAOYSA-N	-2	1	386.385	2.520	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1Cc1nc(-c2cccc(C(=O)[O-])c2)no1	ZINC000832993286	600694348	/nfs/dbraw/zinc/69/43/48/600694348.db2.gz	PFHXDRJMUHJAAN-UHFFFAOYSA-N	-2	1	389.371	2.892	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1C	ZINC000737700321	600893115	/nfs/dbraw/zinc/89/31/15/600893115.db2.gz	QMEKCRWXYKRINR-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)C(C)(C)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1	ZINC000477406504	600898955	/nfs/dbraw/zinc/89/89/55/600898955.db2.gz	QKTSRUUIQUVOLI-UHFFFAOYSA-N	-2	1	391.445	2.945	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc2c(c1)NC(=O)CC2	ZINC000740306619	600898961	/nfs/dbraw/zinc/89/89/61/600898961.db2.gz	ZWAQHWCOZAQTGK-UHFFFAOYSA-N	-2	1	380.809	2.724	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)ccc1F	ZINC000525329677	600899586	/nfs/dbraw/zinc/89/95/86/600899586.db2.gz	IMSNKCLWZRLMHW-UHFFFAOYSA-N	-2	1	394.424	2.947	20	0		GFADML
CCC[C@H]1[C@H](C)CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829246217	600919147	/nfs/dbraw/zinc/91/91/47/600919147.db2.gz	XLVVEXWLSUJDCV-KDOFPFPSSA-N	-2	1	385.464	2.834	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2cnn(-c3ccccc3F)c2)c(F)cc1F	ZINC000740088713	601047882	/nfs/dbraw/zinc/04/78/82/601047882.db2.gz	VYNCSKLEWJSZRC-UHFFFAOYSA-N	-2	1	397.334	2.789	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3ccc(C)c(C(=O)[O-])c3)c2)n[nH]1	ZINC000484637110	601205319	/nfs/dbraw/zinc/20/53/19/601205319.db2.gz	ICVUXRQDTZMBHT-UHFFFAOYSA-N	-2	1	386.433	2.896	20	0		GFADML
CSc1nc(=O)[n-]c(C)c1C(=O)N1CCc2[nH]c3ccc(C(=O)[O-])cc3c2C1	ZINC000832794570	601275344	/nfs/dbraw/zinc/27/53/44/601275344.db2.gz	IQABGFKCRXHTTJ-UHFFFAOYSA-N	-2	1	398.444	2.591	20	0		GFADML
CCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1	ZINC000013345598	601317628	/nfs/dbraw/zinc/31/76/28/601317628.db2.gz	IRHVEMRYUDYYKX-LFYBBSHMSA-N	-2	1	375.402	2.762	20	0		GFADML
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000831373191	601318290	/nfs/dbraw/zinc/31/82/90/601318290.db2.gz	DPRWURAVVBAXFL-POHAHGRESA-N	-2	1	375.402	2.680	20	0		GFADML
COC(=O)/C=C\c1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2C)cc1	ZINC000747595534	601318399	/nfs/dbraw/zinc/31/83/99/601318399.db2.gz	AVQUIMOJRIDYAS-POHAHGRESA-N	-2	1	375.402	2.680	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1OC	ZINC000830085573	601319425	/nfs/dbraw/zinc/31/94/25/601319425.db2.gz	YRVWEUMRVQKCPP-WDZFZDKYSA-N	-2	1	377.418	2.993	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(Cn3cccn3)c2)ccc1F	ZINC000031722495	601321612	/nfs/dbraw/zinc/32/16/12/601321612.db2.gz	IAMFVAWVLTWDJS-UHFFFAOYSA-N	-2	1	375.381	2.570	20	0		GFADML
CCCCC[C@@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000829339625	601404097	/nfs/dbraw/zinc/40/40/97/601404097.db2.gz	KUHDGPYUQDRSBT-SECBINFHSA-N	-2	1	399.694	2.809	20	0		GFADML
COc1ccc(CCC(=O)[O-])cc1NS(=O)(=O)c1ccc(C)c(C(=O)[O-])c1	ZINC000565578760	601488382	/nfs/dbraw/zinc/48/83/82/601488382.db2.gz	ANNXDAAWMOXHFG-UHFFFAOYSA-N	-2	1	393.417	2.520	20	0		GFADML
COCCOc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000327336365	601828383	/nfs/dbraw/zinc/82/83/83/601828383.db2.gz	AGZHOUVLYNUQQM-UHFFFAOYSA-N	-2	1	385.825	2.864	20	0		GFADML
CCCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000829519272	601828857	/nfs/dbraw/zinc/82/88/57/601828857.db2.gz	BDWBKWCKUBLDJH-UHFFFAOYSA-N	-2	1	396.852	2.979	20	0		GFADML
Cc1ccc(NC(=O)C2CC2)cc1[N-]S(=O)(=O)c1cccc(F)c1C(=O)[O-]	ZINC000832941756	601858039	/nfs/dbraw/zinc/85/80/39/601858039.db2.gz	MRNRYFWZQXKDPV-UHFFFAOYSA-N	-2	1	392.408	2.982	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)Nc1cccc(CNC(=O)[O-])c1	ZINC000740205447	602515952	/nfs/dbraw/zinc/51/59/52/602515952.db2.gz	BNDZHAJSARKGFI-UHFFFAOYSA-N	-2	1	393.403	2.501	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)cc1NC(=O)[O-]	ZINC000739925360	602645402	/nfs/dbraw/zinc/64/54/02/602645402.db2.gz	MNNPRLPQXSZGSX-UHFFFAOYSA-N	-3	1	386.407	2.654	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c([O-])c1	ZINC000740700086	602842558	/nfs/dbraw/zinc/84/25/58/602842558.db2.gz	PTXLXCAIQBPUAD-UHFFFAOYSA-N	-2	1	383.404	2.973	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)c([O-])c1	ZINC000740700566	602859668	/nfs/dbraw/zinc/85/96/68/602859668.db2.gz	RDDMHMWTLPVZGJ-UHFFFAOYSA-N	-2	1	375.356	2.710	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)c([O-])c1	ZINC000740697012	602859729	/nfs/dbraw/zinc/85/97/29/602859729.db2.gz	DKVNHISICFZGQW-MRXNPFEDSA-N	-2	1	384.310	2.662	20	0		GFADML
CCCS(=O)(=O)Nc1cccc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])c1	ZINC000739375154	602867463	/nfs/dbraw/zinc/86/74/63/602867463.db2.gz	CSQFBTCDVQTUEM-UHFFFAOYSA-N	-2	1	393.421	2.886	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc2c1CCN(C(=O)[O-])C2	ZINC000740107832	603182637	/nfs/dbraw/zinc/18/26/37/603182637.db2.gz	PUXKZISHCBYODS-UHFFFAOYSA-N	-3	1	390.417	2.530	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)cc1C	ZINC000828789341	603241564	/nfs/dbraw/zinc/24/15/64/603241564.db2.gz	USMJBLSUNYPNBH-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])cc1C	ZINC000827480443	603501151	/nfs/dbraw/zinc/50/11/51/603501151.db2.gz	MIKVJWOQMSQQDJ-UHFFFAOYSA-N	-2	1	393.421	2.804	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc3c(cc2NC(=O)[O-])OCO3)c(C)c1	ZINC000829510812	603888307	/nfs/dbraw/zinc/88/83/07/603888307.db2.gz	OUXOYXAPSBZNHP-UHFFFAOYSA-N	-2	1	380.378	2.623	20	0		GFADML
CCNC(=O)N1CCc2ccc(NC(=O)c3ccc(NC(=O)[O-])cc3[O-])cc21	ZINC000827251249	603915724	/nfs/dbraw/zinc/91/57/24/603915724.db2.gz	XAFDPSGKZJCJCV-UHFFFAOYSA-N	-2	1	384.392	2.826	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC[C@H](c3nnc4ccccn43)C2)c([O-])c1	ZINC000832828983	604769556	/nfs/dbraw/zinc/76/95/56/604769556.db2.gz	NVWUIDCPNDMARF-LBPRGKRZSA-N	-2	1	381.392	2.545	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](CCC(=O)[O-])Cc2ccccc2)c(F)c1	ZINC000833729644	605028143	/nfs/dbraw/zinc/02/81/43/605028143.db2.gz	RUIXBERQGOVGGV-CYBMUJFWSA-N	-2	1	399.415	2.728	20	0		GFADML
O=C([O-])N1CCC2(CCN(C(=O)c3cc(Br)ccc3[O-])C2)CC1	ZINC000834090707	605904931	/nfs/dbraw/zinc/90/49/31/605904931.db2.gz	SZODYXLUTRNQSE-UHFFFAOYSA-N	-2	1	383.242	2.761	20	0		GFADML
CC1N=NC(=S)N1c1cccc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])c1	ZINC000833927930	605985947	/nfs/dbraw/zinc/98/59/47/605985947.db2.gz	PFGAZYURAKFKJI-UHFFFAOYSA-N	-2	1	385.405	2.912	20	0		GFADML
Cc1cccc(S(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)c1Cl	ZINC000826303881	608582980	/nfs/dbraw/zinc/58/29/80/608582980.db2.gz	KIHZFVLIBOBLPA-UHFFFAOYSA-N	-2	1	395.876	2.581	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(N=S(C)(C)=O)cc2)cc1C(=O)[O-]	ZINC000821111525	660316012	/nfs/dbraw/zinc/31/60/12/660316012.db2.gz	MVIJZULITRXJSP-UHFFFAOYSA-N	-2	1	382.463	2.853	20	0		GFADML
CN(C)C(=O)c1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)ccc1Cl	ZINC000032630322	654606484	/nfs/dbraw/zinc/60/64/84/654606484.db2.gz	KISSGEWBYZDPOF-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(C)c(C(=O)[O-])s2)c(F)cc1F	ZINC000045946140	654672717	/nfs/dbraw/zinc/67/27/17/654672717.db2.gz	HELJCUMQAIDZOX-UHFFFAOYSA-N	-2	1	391.373	2.620	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)cc1OC	ZINC000767736866	656217577	/nfs/dbraw/zinc/21/75/77/656217577.db2.gz	RDNSYECSOLOVPY-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1cccc(F)c1	ZINC000776473939	656744835	/nfs/dbraw/zinc/74/48/35/656744835.db2.gz	BPLLMDPLXJDGCH-JTQLQIEISA-N	-2	1	379.196	2.632	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-][C@H]2Cc3ccc(Cl)cc3C2)c1	ZINC000800723670	659329169	/nfs/dbraw/zinc/32/91/69/659329169.db2.gz	SQYVVCCKEDJQSP-LBPRGKRZSA-N	-2	1	387.791	2.762	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)OC3)cc(Cl)c1F	ZINC000808126203	659879243	/nfs/dbraw/zinc/87/92/43/659879243.db2.gz	VKLOZKPTMVJIJJ-UHFFFAOYSA-N	-2	1	385.756	2.649	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@@H]([N-]S(=O)(=O)c1cc(F)c(F)cc1F)CCS2	ZINC000899949151	663703839	/nfs/dbraw/zinc/70/38/39/663703839.db2.gz	MXMQXWNESWUASR-WWNCPBBQSA-N	-2	1	395.424	2.511	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl)C(=O)[O-]	ZINC000479201627	564430854	/nfs/dbraw/zinc/43/08/54/564430854.db2.gz	JBWPQRKHYBMLOQ-BYPYZUCNSA-N	-2	1	377.043	2.507	20	0		GFADML
C[C@@H]1CSC[C@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436623244	563675350	/nfs/dbraw/zinc/67/53/50/563675350.db2.gz	GCCXGGXFIXZOPV-ZWNOBZJWSA-N	-2	1	398.531	2.736	20	0		GFADML
CCC[C@H]([N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)C(=O)[O-]	ZINC000471990461	564209933	/nfs/dbraw/zinc/20/99/33/564209933.db2.gz	XSPJFSZSSZOOCD-VIFPVBQESA-N	-2	1	388.642	2.773	20	0		GFADML
C[S@@](=O)Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(Cl)c1	ZINC000547244957	564481290	/nfs/dbraw/zinc/48/12/90/564481290.db2.gz	FJGIRDFHYYXDKU-HSZRJFAPSA-N	-2	1	387.866	2.718	20	0		GFADML
CC(C)[C@@H](C[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000547931819	564522675	/nfs/dbraw/zinc/52/26/75/564522675.db2.gz	JUDSHBUXYPIQIO-ZCFIWIBFSA-N	-2	1	390.708	2.799	20	0		GFADML
O=C([O-])[C@@H](CC(=O)c1cccs1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000548212202	564536408	/nfs/dbraw/zinc/53/64/08/564536408.db2.gz	LHMHUQGWACIONY-SNVBAGLBSA-N	-2	1	391.829	2.545	20	0		GFADML
C[C@@H](CC[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)CC(=O)[O-]	ZINC000548564055	564561115	/nfs/dbraw/zinc/56/11/15/564561115.db2.gz	RHSAQZODSNRKDX-ZETCQYMHSA-N	-2	1	386.214	2.507	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(C(=O)[O-])c2)cc1Cl	ZINC000484801513	564599555	/nfs/dbraw/zinc/59/95/55/564599555.db2.gz	ZMKVVEHVIRMZHE-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1Cl	ZINC000485264890	564611515	/nfs/dbraw/zinc/61/15/15/564611515.db2.gz	SEGVILHIFWPWJS-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
COc1cc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)c(Cl)cc1C(=O)[O-]	ZINC000485280104	564611980	/nfs/dbraw/zinc/61/19/80/564611980.db2.gz	UWOVKXHAIGULDL-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c(F)c1	ZINC000581691836	564813901	/nfs/dbraw/zinc/81/39/01/564813901.db2.gz	RWLOYVPJYPFXNA-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1cc(Cl)cc(NS(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)c1O	ZINC000462099370	564819564	/nfs/dbraw/zinc/81/95/64/564819564.db2.gz	FANYBZNVSIYQCT-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
CC(C)(C)CC[C@@](C)([N-]S(=O)(=O)c1ccc(Br)o1)C(=O)[O-]	ZINC000556416247	564825216	/nfs/dbraw/zinc/82/52/16/564825216.db2.gz	KMTQSOKHKSTJFP-CYBMUJFWSA-N	-2	1	382.276	2.990	20	0		GFADML
O=C([O-])[C@@H]1C=C[C@@H]([N-]S(=O)(=O)c2cc(Cl)c(Br)cc2F)C1	ZINC000530354205	564877794	/nfs/dbraw/zinc/87/77/94/564877794.db2.gz	YVGPARGZXIZRAO-RNFRBKRXSA-N	-2	1	398.637	2.549	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)[N-]C[C@@H](CCC(=O)[O-])C(F)(F)F)cc1F	ZINC000663293415	565407921	/nfs/dbraw/zinc/40/79/21/565407921.db2.gz	GNPIBZDSUGJVBG-MRVPVSSYSA-N	-2	1	375.315	2.595	20	0		GFADML
Cc1[n-][nH]c(=O)c1NC(=O)c1cccc([N-]S(=O)(=O)c2cccs2)c1	ZINC000646412945	565602217	/nfs/dbraw/zinc/60/22/17/565602217.db2.gz	JGSFXMRNBISJEG-UHFFFAOYSA-N	-2	1	378.435	2.538	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)ccc1F	ZINC000605654569	565955494	/nfs/dbraw/zinc/95/54/94/565955494.db2.gz	SXAWLTOAWPEGNU-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
O=C([O-])C1(NC(=O)c2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCCC1	ZINC000262581500	597038235	/nfs/dbraw/zinc/03/82/35/597038235.db2.gz	QYXQESIZHRPNHK-UHFFFAOYSA-N	-2	1	388.445	2.615	20	0		GFADML
O=C([O-])[C@H]1CCCCN1C(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1[O-]	ZINC000821466366	598148981	/nfs/dbraw/zinc/14/89/81/598148981.db2.gz	WGPARNXLDDRVAH-LLVKDONJSA-N	-2	1	390.314	2.582	20	0		GFADML
CC(C)Oc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(-c2nnn[n-]2)nc1	ZINC000735903999	599302142	/nfs/dbraw/zinc/30/21/42/599302142.db2.gz	KAJZQSNASDBHEL-UHFFFAOYSA-N	-2	1	394.844	2.503	20	0		GFADML
CC(C)Oc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)nc1	ZINC000735903999	599302145	/nfs/dbraw/zinc/30/21/45/599302145.db2.gz	KAJZQSNASDBHEL-UHFFFAOYSA-N	-2	1	394.844	2.503	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccsc2C(=O)[O-])ccc1OCCCC(=O)[O-]	ZINC000738477664	599769254	/nfs/dbraw/zinc/76/92/54/599769254.db2.gz	AHZXLWQGWDUUFY-UHFFFAOYSA-N	-3	1	399.446	2.799	20	0		GFADML
CCOC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)c1	ZINC000737155988	599853128	/nfs/dbraw/zinc/85/31/28/599853128.db2.gz	YOJLUZITGOBCHY-UHFFFAOYSA-N	-2	1	377.418	2.681	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(-c2ncon2)cc1	ZINC000740136220	599982077	/nfs/dbraw/zinc/98/20/77/599982077.db2.gz	SEGSGDMVNVESDD-UHFFFAOYSA-N	-2	1	379.781	2.889	20	0		GFADML
COC(=O)c1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(CSC)cc2)c1	ZINC000737654760	600102072	/nfs/dbraw/zinc/10/20/72/600102072.db2.gz	UOVDHWSFCFGXJM-UHFFFAOYSA-N	-2	1	395.458	2.835	20	0		GFADML
CCOc1cc(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)ccc1C	ZINC000737191970	600123988	/nfs/dbraw/zinc/12/39/88/600123988.db2.gz	MERITRGTGOUENI-UHFFFAOYSA-N	-2	1	395.415	2.752	20	0		GFADML
C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736764867	600184188	/nfs/dbraw/zinc/18/41/88/600184188.db2.gz	XFNBZBOBYCLTDU-XUWXXGDYSA-N	-2	1	383.448	2.586	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCCC[C@H]3c3ccco3)cc2)[n-]1	ZINC000739877062	600214454	/nfs/dbraw/zinc/21/44/54/600214454.db2.gz	JGOSRTOBIODITE-KRWDZBQOSA-N	-2	1	395.415	2.753	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)ccc1F	ZINC000736161417	600255359	/nfs/dbraw/zinc/25/53/59/600255359.db2.gz	QCPANKKJRUNLFG-UHFFFAOYSA-N	-2	1	385.348	2.814	20	0		GFADML
CC(C)(NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)c1cccc(F)c1	ZINC000736339055	600258583	/nfs/dbraw/zinc/25/85/83/600258583.db2.gz	JJABUQPSGHEWMJ-UHFFFAOYSA-N	-2	1	397.406	2.597	20	0		GFADML
CC(C)(C)[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1)C(=O)[O-]	ZINC000675984156	600552873	/nfs/dbraw/zinc/55/28/73/600552873.db2.gz	APIVRRCOUYPWOC-MRXNPFEDSA-N	-2	1	390.461	2.717	20	0		GFADML
CC(C)(C)[C@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1)C(=O)[O-]	ZINC000675985159	600553863	/nfs/dbraw/zinc/55/38/63/600553863.db2.gz	XULQLDFADLKRHA-MRXNPFEDSA-N	-2	1	390.461	2.717	20	0		GFADML
C[S@](=O)Cc1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])c1	ZINC000738180254	600612622	/nfs/dbraw/zinc/61/26/22/600612622.db2.gz	UFDRVDHUANQFSF-QHCPKHFHSA-N	-2	1	387.866	2.718	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2cccc(N3CCCCC3=O)c2)cc1	ZINC000267120352	600626171	/nfs/dbraw/zinc/62/61/71/600626171.db2.gz	AQIUFIDEDDGBSH-UHFFFAOYSA-N	-2	1	388.445	2.631	20	0		GFADML
CCCc1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)c(C(=O)[O-])c1	ZINC000481986313	600626936	/nfs/dbraw/zinc/62/69/36/600626936.db2.gz	YVKCOYGHQIBRJK-UHFFFAOYSA-N	-3	1	377.418	2.765	20	0		GFADML
COc1ccccc1-c1nc(C(=O)[N-]c2nnc(CCC(=O)[O-])s2)cs1	ZINC000738114207	600629356	/nfs/dbraw/zinc/62/93/56/600629356.db2.gz	SIZJOSSXNCWENA-UHFFFAOYSA-N	-2	1	390.446	2.940	20	0		GFADML
CC(=O)N1CCc2ccc(S(=O)(=O)[N-]c3cc(Cl)cc(C(=O)[O-])c3)cc21	ZINC000736140031	600635844	/nfs/dbraw/zinc/63/58/44/600635844.db2.gz	UIQJTWYCPZJQAQ-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
CC(C)C[C@H](C[N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000794915211	600765003	/nfs/dbraw/zinc/76/50/03/600765003.db2.gz	USAABEMFHBBLIO-MRVPVSSYSA-N	-2	1	399.694	2.523	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000067124397	600813225	/nfs/dbraw/zinc/81/32/25/600813225.db2.gz	GBHLCBVCENOYNU-UHFFFAOYSA-N	-2	1	377.422	2.635	20	0		GFADML
CCCNC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000737028598	600890518	/nfs/dbraw/zinc/89/05/18/600890518.db2.gz	LHYPGGNSIXLANQ-UHFFFAOYSA-N	-2	1	396.852	2.979	20	0		GFADML
COC(=O)C(C)(C)c1ccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])cc1	ZINC000737562050	600899357	/nfs/dbraw/zinc/89/93/57/600899357.db2.gz	JUOGFMRYYKYSPZ-UHFFFAOYSA-N	-2	1	377.418	2.636	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(C)(C)C(=O)[O-])cc1	ZINC000524813159	600899572	/nfs/dbraw/zinc/89/95/72/600899572.db2.gz	IOUYCEHBWQHSBU-UHFFFAOYSA-N	-3	1	395.408	2.995	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2cnn(-c3ccccc3F)c2)c(F)c1	ZINC000484547566	601048274	/nfs/dbraw/zinc/04/82/74/601048274.db2.gz	SRACYDVCBVVWSN-UHFFFAOYSA-N	-2	1	379.344	2.650	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3cccc(C(=O)[O-])c3C)c2)n[nH]1	ZINC000477406401	601205402	/nfs/dbraw/zinc/20/54/02/601205402.db2.gz	ZOAPYTRZOOJQIA-UHFFFAOYSA-N	-2	1	386.433	2.896	20	0		GFADML
COC(=O)/C=C\c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])cc1	ZINC000747609643	601323116	/nfs/dbraw/zinc/32/31/16/601323116.db2.gz	VXASJIOFLNDMBQ-WTKPLQERSA-N	-2	1	379.365	2.511	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000829799305	601323250	/nfs/dbraw/zinc/32/32/50/601323250.db2.gz	GNECXWKEMQAQDN-XFFZJAGNSA-N	-2	1	388.445	2.643	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c(C)c1	ZINC000515691229	601325679	/nfs/dbraw/zinc/32/56/79/601325679.db2.gz	WSDWIFKGDFNCCU-UHFFFAOYSA-N	-2	1	390.461	2.861	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(C(=O)N(C)C)c(C)c2)c1C	ZINC000265833263	601331746	/nfs/dbraw/zinc/33/17/46/601331746.db2.gz	CXKHKHOMBDHVKP-UHFFFAOYSA-N	-2	1	390.461	2.813	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000736232818	601332281	/nfs/dbraw/zinc/33/22/81/601332281.db2.gz	OSXHFUGMNNRSBY-UHFFFAOYSA-N	-3	1	381.381	2.687	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1c2nsnc2ccc1Cl	ZINC000327270803	601332498	/nfs/dbraw/zinc/33/24/98/601332498.db2.gz	SOZNAZJCHVWZGD-UHFFFAOYSA-N	-2	1	399.837	2.852	20	0		GFADML
CC1=C(C(=O)[O-])[C@H](c2cc(F)c([O-])c(F)c2)NC(=O)N1CCCCCC(=O)[O-]	ZINC000828134520	601396796	/nfs/dbraw/zinc/39/67/96/601396796.db2.gz	HNUKALYJRRKCQM-HNNXBMFYSA-N	-3	1	398.362	2.740	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(-c3ccccc3)n[nH]2)cc(F)c1F	ZINC000833303992	601487987	/nfs/dbraw/zinc/48/79/87/601487987.db2.gz	FMXJKFNLQTYBDZ-UHFFFAOYSA-N	-2	1	379.344	2.854	20	0		GFADML
CC[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C)c2)cc1)C(=O)[O-]	ZINC000486187701	601750875	/nfs/dbraw/zinc/75/08/75/601750875.db2.gz	KOLXBQLZGSFHNJ-INIZCTEOSA-N	-2	1	394.424	2.528	20	0		GFADML
COC(=O)c1cc2cc([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])ccc2o1	ZINC000831353953	601858059	/nfs/dbraw/zinc/85/80/59/601858059.db2.gz	PVGQJKKYXCPVHD-UHFFFAOYSA-N	-2	1	393.348	2.858	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])c1	ZINC000831705210	601862876	/nfs/dbraw/zinc/86/28/76/601862876.db2.gz	BYFRXMBBMAYNFW-UHFFFAOYSA-N	-2	1	383.397	2.740	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)OCCNC(=O)[O-])cc2)cc1C	ZINC000738655438	602221318	/nfs/dbraw/zinc/22/13/18/602221318.db2.gz	VKXXAAUDPXJPTC-UHFFFAOYSA-N	-2	1	392.433	2.529	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cc(C2CCCCC2)n[nH]1	ZINC000832204108	602308179	/nfs/dbraw/zinc/30/81/79/602308179.db2.gz	DLUJFSLSUQHBHS-UHFFFAOYSA-N	-2	1	379.438	2.965	20	0		GFADML
CC(C)[C@H](NC(=O)[O-])C(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000736382806	602396770	/nfs/dbraw/zinc/39/67/70/602396770.db2.gz	SGKMDIMYSHACIB-INIZCTEOSA-N	-2	1	391.449	2.718	20	0		GFADML
COCCOc1ccc(S(=O)(=O)[N-]c2ccccc2NC(=O)[O-])cc1C	ZINC000739840706	602652972	/nfs/dbraw/zinc/65/29/72/602652972.db2.gz	ZXSVFKFDQPRJPL-UHFFFAOYSA-N	-2	1	380.422	2.911	20	0		GFADML
COC(=O)c1ccc(F)cc1S(=O)(=O)[N-]c1cc(NC(=O)[O-])ccc1F	ZINC000739785353	602653049	/nfs/dbraw/zinc/65/30/49/602653049.db2.gz	UTDIUMAYSDPOFH-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
CCOC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)c1	ZINC000739480627	602655186	/nfs/dbraw/zinc/65/51/86/602655186.db2.gz	ZEVVVOIZOZRFFI-UHFFFAOYSA-N	-2	1	392.433	2.774	20	0		GFADML
CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])c1	ZINC000739250559	602850830	/nfs/dbraw/zinc/85/08/30/602850830.db2.gz	RGYIWSBBMKSMOI-LBPRGKRZSA-N	-2	1	385.420	2.940	20	0		GFADML
CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738715625	602854028	/nfs/dbraw/zinc/85/40/28/602854028.db2.gz	HRVQBVRSTGDWOI-GFCCVEGCSA-N	-2	1	393.440	2.859	20	0		GFADML
CCCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])cc1	ZINC000739375673	602854565	/nfs/dbraw/zinc/85/45/65/602854565.db2.gz	WLIVLBJDYPZXSU-UHFFFAOYSA-N	-2	1	393.421	2.886	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)c([O-])c1	ZINC000740697027	602863370	/nfs/dbraw/zinc/86/33/70/602863370.db2.gz	FECHTYJVWCOFIZ-ZDUSSCGKSA-N	-2	1	389.795	2.671	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@@H]2CCCN(C(=O)[O-])C2)c([O-])c1	ZINC000736283534	602864283	/nfs/dbraw/zinc/86/42/83/602864283.db2.gz	KBNHZJGAOYSWIE-GFCCVEGCSA-N	-2	1	379.413	2.611	20	0		GFADML
CN(C)[C@@H](CNC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1c(F)cccc1F	ZINC000739607332	602865383	/nfs/dbraw/zinc/86/53/83/602865383.db2.gz	JHRCNFLTCWZNSY-AWEZNQCLSA-N	-2	1	379.363	2.793	20	0		GFADML
CCc1cc2c(COC(=O)[C@H]3CCC[C@H]3NC(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000739542636	603127622	/nfs/dbraw/zinc/12/76/22/603127622.db2.gz	LGTZGMMJLYJMND-GXTWGEPZSA-N	-2	1	375.377	2.541	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC[C@H]([C@@H]2CCCN2C(=O)[O-])C1	ZINC000830709541	603480961	/nfs/dbraw/zinc/48/09/61/603480961.db2.gz	LPWXODXPKNYQNV-KBPBESRZSA-N	-2	1	376.457	2.609	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)ccc1C	ZINC000828760845	603544617	/nfs/dbraw/zinc/54/46/17/603544617.db2.gz	ISZGXGWWKKWKHK-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
CC(C)C[C@@H](CNC(=O)[O-])NC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1	ZINC000824192159	603660940	/nfs/dbraw/zinc/66/09/40/603660940.db2.gz	YUOZKEWXWYBSIO-INIZCTEOSA-N	-2	1	391.468	2.679	20	0		GFADML
C[C@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1nc(Cc2ccccc2)no1	ZINC000825464882	603840789	/nfs/dbraw/zinc/84/07/89/603840789.db2.gz	GESPWNHZIALISX-NSHDSACASA-N	-2	1	382.376	2.947	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc([C@H](C)NC(=O)[O-])cc1	ZINC000829855392	604314866	/nfs/dbraw/zinc/31/48/66/604314866.db2.gz	UITNRQZLJFACID-NSHDSACASA-N	-3	1	378.406	2.823	20	0		GFADML
COC(=O)[C@H](c1cccc(C(=O)[O-])c1)N1CCC(C(=O)c2ccc([O-])cc2)CC1	ZINC000833700064	604481543	/nfs/dbraw/zinc/48/15/43/604481543.db2.gz	AINLYPULOGNGDL-IBGZPJMESA-N	-2	1	397.427	2.899	20	0		GFADML
O=C([O-])C[C@@H]1CCCN1C(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000263039469	604593712	/nfs/dbraw/zinc/59/37/12/604593712.db2.gz	VPDMYYQJABLJET-INIZCTEOSA-N	-2	1	388.445	2.567	20	0		GFADML
O=C([O-])NCc1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)cc1	ZINC000833280785	604771991	/nfs/dbraw/zinc/77/19/91/604771991.db2.gz	QAFUAHLYBIHFTN-UHFFFAOYSA-N	-2	1	384.797	2.607	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ncccc2Br)ccc1Cl	ZINC000091272201	604797012	/nfs/dbraw/zinc/79/70/12/604797012.db2.gz	ZEBWOHBYHZNMBH-UHFFFAOYSA-N	-2	1	391.630	2.997	20	0		GFADML
Cc1nc(C2([N-]S(=O)(=O)c3cc(F)ccc3C(=O)[O-])CCCCCC2)no1	ZINC000833755129	605017881	/nfs/dbraw/zinc/01/78/81/605017881.db2.gz	APIUHBIPVLZEPL-UHFFFAOYSA-N	-2	1	397.428	2.743	20	0		GFADML
CC(C)(C)NC(=O)c1cccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)c1	ZINC000485255014	605160509	/nfs/dbraw/zinc/16/05/09/605160509.db2.gz	VICBLRFDELNAHE-UHFFFAOYSA-N	-2	1	394.424	2.853	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)OCc1cc(C(=O)[O-])ccc1F	ZINC000833666225	605814004	/nfs/dbraw/zinc/81/40/04/605814004.db2.gz	XYXJKTVOYBRDOY-UHFFFAOYSA-N	-2	1	381.381	2.643	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])[C@@H](C)CN1C(=O)[O-]	ZINC000833835701	605837382	/nfs/dbraw/zinc/83/73/82/605837382.db2.gz	CSFJCDPPNAHFFE-NWDGAFQWSA-N	-2	1	393.440	2.952	20	0		GFADML
CS(C)(=O)=Nc1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000821111872	660316278	/nfs/dbraw/zinc/31/62/78/660316278.db2.gz	VGGXBBZXQWZXKY-UHFFFAOYSA-N	-2	1	386.426	2.684	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000013278863	654503972	/nfs/dbraw/zinc/50/39/72/654503972.db2.gz	UNIZOLZAPNXHOP-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
O=C([O-])c1cccc(CC[N-]S(=O)(=O)c2sccc2Br)c1	ZINC000111403943	655172746	/nfs/dbraw/zinc/17/27/46/655172746.db2.gz	JHGKTZHTUJSJEO-UHFFFAOYSA-N	-2	1	390.280	2.730	20	0		GFADML
COc1ccc(CCC(=O)[O-])cc1[N-]S(=O)(=O)Cc1ccc(Cl)nc1	ZINC000275037381	655213051	/nfs/dbraw/zinc/21/30/51/655213051.db2.gz	QRQORDPFVKEIBE-UHFFFAOYSA-N	-2	1	384.841	2.703	20	0		GFADML
CCC[C@@H]([N-]S(=O)(=O)c1csnc1C(=O)[O-])c1ccc(F)cc1F	ZINC000577369466	655457805	/nfs/dbraw/zinc/45/78/05/655457805.db2.gz	DQYMGCJLUVXMGY-LLVKDONJSA-N	-2	1	376.406	2.939	20	0		GFADML
CC(C)c1cc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)on1	ZINC000761298531	656009172	/nfs/dbraw/zinc/00/91/72/656009172.db2.gz	YNNXTTYBBZNECI-UHFFFAOYSA-N	-2	1	376.793	2.767	20	0		GFADML
C[C@@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F)Cc1cccs1	ZINC000761308353	656009908	/nfs/dbraw/zinc/00/99/08/656009908.db2.gz	RAJNDDHYRORXHA-SECBINFHSA-N	-2	1	375.418	2.882	20	0		GFADML
C[C@@H]1CC[C@](C[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)(CC(=O)[O-])C1	ZINC000776626200	656770145	/nfs/dbraw/zinc/77/01/45/656770145.db2.gz	LLSWVBKKENEJHW-YMTOWFKASA-N	-2	1	381.281	2.948	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccccc2[C@@H](O)C(F)(F)F)cc1	ZINC000777744141	656833591	/nfs/dbraw/zinc/83/35/91/656833591.db2.gz	MIJJBUWPOQGRAS-CYBMUJFWSA-N	-2	1	375.324	2.781	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(F)c(C(=O)[O-])c(F)c2)c(C)c1F	ZINC000782912487	657192600	/nfs/dbraw/zinc/19/26/00/657192600.db2.gz	JSFSKOLHKILTST-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
COc1nc2ccc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)cc2s1	ZINC000788139949	657656887	/nfs/dbraw/zinc/65/68/87/657656887.db2.gz	ROSBVJFJDZJECG-UHFFFAOYSA-N	-2	1	382.394	2.943	20	0		GFADML
COc1cc(C(=O)NC[C@@H](SCC(=O)[O-])C(F)(F)F)cc(Cl)c1[O-]	ZINC000910350369	664206812	/nfs/dbraw/zinc/20/68/12/664206812.db2.gz	SRKMQAVBXGAANB-SECBINFHSA-N	-2	1	387.763	2.533	20	0		GFADML
COc1cc(C(=O)N2CC[C@@H](c3ncc(C(=O)[O-])s3)C2)cc(Cl)c1[O-]	ZINC000911040505	664234275	/nfs/dbraw/zinc/23/42/75/664234275.db2.gz	QYPNDCLKXJSMRC-MRVPVSSYSA-N	-2	1	382.825	2.839	20	0		GFADML
CSCC[C@@H]([N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl)C(=O)[O-]	ZINC000231725274	553066300	/nfs/dbraw/zinc/06/63/00/553066300.db2.gz	YYXYFRIWAPSCPN-SSDOTTSWSA-N	-2	1	376.258	2.617	20	0		GFADML
O=C([O-])[C@H]1CC[C@H](C[N-]S(=O)(=O)c2sccc2Br)CC1	ZINC000253336295	553151008	/nfs/dbraw/zinc/15/10/08/553151008.db2.gz	YGQCERHCHMZNPZ-KYZUINATSA-N	-2	1	382.301	2.680	20	0		GFADML
CSC1(CNC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])CC1	ZINC000280118666	563323176	/nfs/dbraw/zinc/32/31/76/563323176.db2.gz	OBSHCGQMPLJVOU-UHFFFAOYSA-N	-2	1	398.531	2.880	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)OC(F)(F)O2	ZINC000324563952	563453152	/nfs/dbraw/zinc/45/31/52/563453152.db2.gz	AZDCVGIOWWLGKY-UHFFFAOYSA-N	-2	1	377.346	2.877	20	0		GFADML
CCn1cc(S(=O)(=O)[N-]c2ccc(OC(F)(F)F)cc2)cc1C(=O)[O-]	ZINC000327314231	563457667	/nfs/dbraw/zinc/45/76/67/563457667.db2.gz	RSUAZMNDPNDSAE-UHFFFAOYSA-N	-2	1	378.328	2.906	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc2c(c1)NC(=O)CS2	ZINC000327381584	563458001	/nfs/dbraw/zinc/45/80/01/563458001.db2.gz	GCZPSWRNSPTSSP-UHFFFAOYSA-N	-2	1	378.431	2.538	20	0		GFADML
O=C([O-])C[C@@H](CC[N-]S(=O)(=O)c1cnc(Cl)c(Cl)c1)C(F)(F)F	ZINC000285033119	563499646	/nfs/dbraw/zinc/49/96/46/563499646.db2.gz	IPINGDOOKDBDPD-ZCFIWIBFSA-N	-2	1	395.186	2.710	20	0		GFADML
O=C([O-])C[C@H](CC[N-]S(=O)(=O)c1cccc(Cl)c1F)C(F)(F)F	ZINC000285323537	563514571	/nfs/dbraw/zinc/51/45/71/563514571.db2.gz	ZVNQPMSZTOOSDA-ZETCQYMHSA-N	-2	1	377.743	2.801	20	0		GFADML
Cc1c(Br)cccc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1[O-]	ZINC000433526852	563615008	/nfs/dbraw/zinc/61/50/08/563615008.db2.gz	XMZJWWVWTTZWNY-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
C[C@H]1C[C@H](NC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])CS1	ZINC000412569296	563661740	/nfs/dbraw/zinc/66/17/40/563661740.db2.gz	HRHVMCARIKEVCU-JQWIXIFHSA-N	-2	1	398.531	2.878	20	0		GFADML
COC(=O)c1cccc(F)c1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(Cl)c1	ZINC000436170991	563666216	/nfs/dbraw/zinc/66/62/16/563666216.db2.gz	NCLMCNRQDKUEPB-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CNS(=O)(=O)c1ccc([O-])c(NC(=O)c2c([O-])cc(Cl)cc2Cl)c1	ZINC000436619259	563675364	/nfs/dbraw/zinc/67/53/64/563675364.db2.gz	QPOLEVMZNSIQEG-UHFFFAOYSA-N	-2	1	391.232	2.565	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(OC(F)F)c(F)c2)cc1O	ZINC000447781403	563885895	/nfs/dbraw/zinc/88/58/95/563885895.db2.gz	BXJTULMPHOESMD-UHFFFAOYSA-N	-2	1	377.296	2.632	20	0		GFADML
CCSc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)c1	ZINC000505318114	564180365	/nfs/dbraw/zinc/18/03/65/564180365.db2.gz	SPFBKOKGZWCZDB-UHFFFAOYSA-N	-3	1	381.431	2.996	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)cc1Cl	ZINC000506673462	564209360	/nfs/dbraw/zinc/20/93/60/564209360.db2.gz	COVJDRDMRQFYCV-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1Cl)c1nc(C(C)(C)C)no1	ZINC000565061346	564264677	/nfs/dbraw/zinc/26/46/77/564264677.db2.gz	CAZZKXFOJFBQHZ-MRVPVSSYSA-N	-2	1	387.845	2.758	20	0		GFADML
CSc1c(F)cc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])cc2)cc1F	ZINC000541302957	564274398	/nfs/dbraw/zinc/27/43/98/564274398.db2.gz	VFZUUILNMOLUPI-UHFFFAOYSA-N	-2	1	389.401	2.951	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(CC(=O)[O-])cc1	ZINC000475732658	564317543	/nfs/dbraw/zinc/31/75/43/564317543.db2.gz	IGEXCLLKRPPICO-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2c(c1)CC(=O)N2	ZINC000475753357	564318488	/nfs/dbraw/zinc/31/84/88/564318488.db2.gz	XDUWSMGHAWHASQ-UHFFFAOYSA-N	-2	1	380.809	2.642	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cccc(CC(=O)[O-])c2)cc1Cl	ZINC000568575022	564424722	/nfs/dbraw/zinc/42/47/22/564424722.db2.gz	YDRSZVZANUWTAC-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cccc(F)c1F)Cc1ccccc1Cl	ZINC000548530817	564556106	/nfs/dbraw/zinc/55/61/06/564556106.db2.gz	UPQFLOZFMBUMMF-NSHDSACASA-N	-2	1	389.807	2.840	20	0		GFADML
CCc1ncc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Br)s1	ZINC000548576873	564563179	/nfs/dbraw/zinc/56/31/79/564563179.db2.gz	RKCGFHINIYQNRA-UHFFFAOYSA-N	-2	1	391.268	2.967	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C1CCC1	ZINC000548596951	564565768	/nfs/dbraw/zinc/56/57/68/564565768.db2.gz	XVXUYBOCKSNRSU-QMMMGPOBSA-N	-2	1	388.692	2.696	20	0		GFADML
O=C([O-])[C@@H]1CCC[C@@H]1C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000580818235	564775561	/nfs/dbraw/zinc/77/55/61/564775561.db2.gz	WRXWZNNAIGWTTI-HTQZYQBOSA-N	-2	1	398.225	2.507	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C)c(C(=O)N(C)C)c1	ZINC000531195948	564903444	/nfs/dbraw/zinc/90/34/44/564903444.db2.gz	WQIIGAVBSZGNQK-UHFFFAOYSA-N	-2	1	382.463	2.566	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)c1	ZINC000532845416	564947349	/nfs/dbraw/zinc/94/73/49/564947349.db2.gz	WTQZEZBRUHTXDF-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COC(=O)[C@@H](C)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)cc1	ZINC000562735109	565040669	/nfs/dbraw/zinc/04/06/69/565040669.db2.gz	BJSCOFYXZJYQTJ-VIFPVBQESA-N	-2	1	383.447	2.832	20	0		GFADML
COC1(CS(=O)(=O)[N-]c2cc(Br)ccc2C(=O)[O-])CCCC1	ZINC000584808876	565099293	/nfs/dbraw/zinc/09/92/93/565099293.db2.gz	OJVXLADXBHYDEM-UHFFFAOYSA-N	-2	1	392.271	2.848	20	0		GFADML
O=C(NCCC1CSC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000616403373	565199674	/nfs/dbraw/zinc/19/96/74/565199674.db2.gz	OAUOZMWVSVOYKT-UHFFFAOYSA-N	-2	1	398.531	2.737	20	0		GFADML
C[C@@H]1CC[C@@](C[N-]S(=O)(=O)c2ncccc2C(F)(F)F)(CC(=O)[O-])C1	ZINC000650412967	565818165	/nfs/dbraw/zinc/81/81/65/565818165.db2.gz	WDBRZSMNGBFZLA-YGRLFVJLSA-N	-2	1	380.388	2.660	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C[S@@](C)=O)c1	ZINC000609658271	566048264	/nfs/dbraw/zinc/04/82/64/566048264.db2.gz	CRBYPLMANDDHCN-XMMPIXPASA-N	-2	1	381.475	2.627	20	0		GFADML
CO[C@H](C[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-])C1CC1	ZINC000656168140	566108332	/nfs/dbraw/zinc/10/83/32/566108332.db2.gz	DEQSKZMTYAZVJH-HTQZYQBOSA-N	-2	1	388.294	2.602	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl)C(=O)[O-]	ZINC000034936962	602173274	/nfs/dbraw/zinc/17/32/74/602173274.db2.gz	OKYDYHDQATUGRO-SCSAIBSYSA-N	-2	1	377.043	2.507	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccccc2CC(=O)[O-])ccc1Cl	ZINC000818520443	596975483	/nfs/dbraw/zinc/97/54/83/596975483.db2.gz	WVCSTDJFUULLDS-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
Cc1ccc(C(=O)N[C@@H](C)C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cl)c1	ZINC000427310296	599759351	/nfs/dbraw/zinc/75/93/51/599759351.db2.gz	TZNZKVVMNLABOX-NSHDSACASA-N	-2	1	396.852	2.652	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(C(=O)NC[C@H](C)C(=O)[O-])cc2)c1	ZINC000655559882	599779990	/nfs/dbraw/zinc/77/99/90/599779990.db2.gz	CFXJVPRTHXZDCG-AWEZNQCLSA-N	-2	1	390.461	2.555	20	0		GFADML
CN1C(=O)CCc2cc([N-]S(=O)(=O)c3cc(Cl)ccc3C(=O)[O-])ccc21	ZINC000737511014	599855118	/nfs/dbraw/zinc/85/51/18/599855118.db2.gz	ZPCANALBZGLKEG-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
CCCN(CC(=O)[O-])C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)cc2)cc1	ZINC000262357193	600022624	/nfs/dbraw/zinc/02/26/24/600022624.db2.gz	HPBKRTMMTOTASB-UHFFFAOYSA-N	-2	1	390.461	2.733	20	0		GFADML
COC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000737635083	600097678	/nfs/dbraw/zinc/09/76/78/600097678.db2.gz	XSVVLEQCIJPILU-UHFFFAOYSA-N	-2	1	382.369	2.527	20	0		GFADML
CC(=O)c1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2N2CCCC2)cc1	ZINC000736191617	600105025	/nfs/dbraw/zinc/10/50/25/600105025.db2.gz	LJSSQEUXNLPZDK-UHFFFAOYSA-N	-2	1	388.445	2.988	20	0		GFADML
C[C@@H](OC(=O)c1ccc(Cl)c(Cl)c1[O-])C(=O)N1CCC(C(=O)[O-])CC1	ZINC000736692547	600109266	/nfs/dbraw/zinc/10/92/66/600109266.db2.gz	WEAOWWGDFBPHAV-MRVPVSSYSA-N	-2	1	390.219	2.568	20	0		GFADML
CC(C)OC(=O)NCc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1	ZINC000735027987	600254481	/nfs/dbraw/zinc/25/44/81/600254481.db2.gz	PFEKNJZKMTYNNS-UHFFFAOYSA-N	-2	1	392.433	2.820	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CN(C)C(=O)[O-])cc1	ZINC000737257387	600299700	/nfs/dbraw/zinc/29/97/00/600299700.db2.gz	OAURZRWWWSJQQS-UHFFFAOYSA-N	-3	1	392.433	2.858	20	0		GFADML
COCCc1ccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)cc1	ZINC000737822991	600300625	/nfs/dbraw/zinc/30/06/25/600300625.db2.gz	BGPBLONUSRLFOE-UHFFFAOYSA-N	-2	1	378.450	2.786	20	0		GFADML
C[C@H]1CCCC[C@@H]1CCNC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736777779	600424812	/nfs/dbraw/zinc/42/48/12/600424812.db2.gz	DGLXZDFJEGKOMU-LSDHHAIUSA-N	-2	1	385.464	2.739	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)ccc1Cl	ZINC000042791979	600542026	/nfs/dbraw/zinc/54/20/26/600542026.db2.gz	CXIIRJVIVDOAKC-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2cccc(OC[C@H]3CCCO3)c2)cc1	ZINC000267203818	600626406	/nfs/dbraw/zinc/62/64/06/600626406.db2.gz	QXWCQAONRRPOFV-QGZVFWFLSA-N	-2	1	391.445	2.672	20	0		GFADML
CC(C)c1cccc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(CC(=O)[O-])cc1	ZINC000481949372	600627447	/nfs/dbraw/zinc/62/74/47/600627447.db2.gz	BGHADPNDJJPWEC-UHFFFAOYSA-N	-3	1	377.418	2.936	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3nc([C@H]4CCCO4)[nH]c3c2)cs1	ZINC000299292011	600677036	/nfs/dbraw/zinc/67/70/36/600677036.db2.gz	KASWBWPAFHIGHQ-CYBMUJFWSA-N	-2	1	393.446	2.975	20	0		GFADML
COC(=O)Cc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000737627975	600888222	/nfs/dbraw/zinc/88/82/22/600888222.db2.gz	NIMHQVPQHMFGDJ-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2ccc(C(C)(C)C(=O)[O-])cc2)c1	ZINC000438766445	600899937	/nfs/dbraw/zinc/89/99/37/600899937.db2.gz	RRQWVSVGNPPJMM-UHFFFAOYSA-N	-2	1	393.417	2.562	20	0		GFADML
CCC[C@H]1[C@@H](C)CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829246218	600919163	/nfs/dbraw/zinc/91/91/63/600919163.db2.gz	XLVVEXWLSUJDCV-KSSFIOAISA-N	-2	1	385.464	2.834	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])o1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000827756202	600988362	/nfs/dbraw/zinc/98/83/62/600988362.db2.gz	YOAOFZWEWYLARG-MRVPVSSYSA-N	-2	1	397.796	2.721	20	0		GFADML
C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000828161781	601139866	/nfs/dbraw/zinc/13/98/66/601139866.db2.gz	PKMWYAGFJRSNSU-GUYCJALGSA-N	-2	1	385.464	2.737	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)ccc2o1	ZINC000831831731	601230356	/nfs/dbraw/zinc/23/03/56/601230356.db2.gz	PCQXUUVXWYWEFG-UHFFFAOYSA-N	-2	1	380.353	2.612	20	0		GFADML
O=C([O-])Nc1cc([N-]S(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)ccc1F	ZINC000833283630	601233292	/nfs/dbraw/zinc/23/32/92/601233292.db2.gz	SVNDDMUMGPUMNX-UHFFFAOYSA-N	-2	1	377.353	2.558	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1C(=O)N(C)C	ZINC000433529499	601250625	/nfs/dbraw/zinc/25/06/25/601250625.db2.gz	JOADEXOMNDGEJD-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000013278929	601320002	/nfs/dbraw/zinc/32/00/02/601320002.db2.gz	YFJWDYAWLJIHGD-UHFFFAOYSA-N	-3	1	385.394	2.745	20	0		GFADML
Cc1ccc(C(=O)NC2CC2)cc1[N-]S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000738260232	601323389	/nfs/dbraw/zinc/32/33/89/601323389.db2.gz	KIDWRIYVEGZPRW-UHFFFAOYSA-N	-2	1	392.408	2.525	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])c1	ZINC000831248414	601323507	/nfs/dbraw/zinc/32/35/07/601323507.db2.gz	MLYHWBVOOIRBSW-UHFFFAOYSA-N	-2	1	381.381	2.728	20	0		GFADML
CC[C@@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000057121443	601325494	/nfs/dbraw/zinc/32/54/94/601325494.db2.gz	BQDVIISMQWUKSF-LLVKDONJSA-N	-2	1	394.424	2.853	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C)c(C(=O)[O-])c2)cc(F)c1F	ZINC000755973710	601485759	/nfs/dbraw/zinc/48/57/59/601485759.db2.gz	CXZFLPIPBIVVLQ-UHFFFAOYSA-N	-2	1	385.344	2.559	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)c1cc(F)c(F)c(C(=O)[O-])c1	ZINC000751214553	601485790	/nfs/dbraw/zinc/48/57/90/601485790.db2.gz	ADWFUTDTDUFAMT-UHFFFAOYSA-N	-3	1	385.344	2.724	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(F)c(C(=O)N(C)C)c2)c1C	ZINC000530994762	601785202	/nfs/dbraw/zinc/78/52/02/601785202.db2.gz	WPVVROVCNPTEJL-UHFFFAOYSA-N	-2	1	394.424	2.643	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)Nc1scc(C2CC2)c1C(=O)[O-]	ZINC000738365516	601808688	/nfs/dbraw/zinc/80/86/88/601808688.db2.gz	OKOKEVYELRVYSP-UHFFFAOYSA-N	-2	1	386.433	2.870	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(NC(=O)C3CC3)c2)cc(F)c1F	ZINC000751147860	601833339	/nfs/dbraw/zinc/83/33/39/601833339.db2.gz	WIXUEKIGSILCRM-UHFFFAOYSA-N	-2	1	396.371	2.812	20	0		GFADML
O=C([O-])c1nscc1S(=O)(=O)[N-]c1ccc2nc(-c3ccco3)[nH]c2c1	ZINC000833345338	601839154	/nfs/dbraw/zinc/83/91/54/601839154.db2.gz	ABINWYKUPOJKRE-UHFFFAOYSA-N	-2	1	390.402	2.778	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])ccc1Cl	ZINC000825890327	601859015	/nfs/dbraw/zinc/85/90/15/601859015.db2.gz	KXXHIIVGDPCDJH-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
CC(C)C1CCC(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CC1	ZINC000826728063	602066004	/nfs/dbraw/zinc/06/60/04/602066004.db2.gz	YHXCRNMSCAFYCO-UHFFFAOYSA-N	-2	1	385.464	2.737	20	0		GFADML
CCOC(=O)c1ccc(S(=O)(=O)[N-][C@@H](c2ccccc2)C(C)(C)C(=O)[O-])o1	ZINC000829881670	602217817	/nfs/dbraw/zinc/21/78/17/602217817.db2.gz	SMMCRWPALLIEIN-HNNXBMFYSA-N	-2	1	395.433	2.587	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(CCc3ccccc3)[nH]n2)cs1	ZINC000833304286	602308631	/nfs/dbraw/zinc/30/86/31/602308631.db2.gz	XENOPYZHQSEMKG-UHFFFAOYSA-N	-2	1	377.447	2.755	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc(C(=O)CCC(=O)[O-])c2)ccc1C(=O)[O-]	ZINC000507905562	602308952	/nfs/dbraw/zinc/30/89/52/602308952.db2.gz	OABBUQIFHZHEGN-UHFFFAOYSA-N	-3	1	391.401	2.542	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c([O-])c1	ZINC000740700424	602848093	/nfs/dbraw/zinc/84/80/93/602848093.db2.gz	MRLDJEDPWYKDLS-INIZCTEOSA-N	-2	1	385.376	2.852	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2cccc(CN3CCCC3=O)c2)c([O-])c1	ZINC000740698567	602849968	/nfs/dbraw/zinc/84/99/68/602849968.db2.gz	OBVHRYCAVTXKNA-UHFFFAOYSA-N	-2	1	383.404	2.535	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(CC(=O)NC3CCCC3)CC2)c([O-])c1	ZINC000740700483	602855836	/nfs/dbraw/zinc/85/58/36/602855836.db2.gz	YDDPEPUITHTLOH-UHFFFAOYSA-N	-2	1	389.452	2.783	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])CC[C@@H]1NC(=O)[O-]	ZINC000739164390	602869260	/nfs/dbraw/zinc/86/92/60/602869260.db2.gz	CPQGHWYSRYGEJK-RISCZKNCSA-N	-2	1	393.440	2.857	20	0		GFADML
CCC[C@@H](NC(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000739321722	603233856	/nfs/dbraw/zinc/23/38/56/603233856.db2.gz	KZTFPEWSWUGKQO-MRXNPFEDSA-N	-2	1	391.449	2.862	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)c1C	ZINC000828800042	603401070	/nfs/dbraw/zinc/40/10/70/603401070.db2.gz	UPOYCRZAWQKQRZ-GFCCVEGCSA-N	-2	1	392.433	2.911	20	0		GFADML
COC(=O)C=Cc1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])cc2)cc1	ZINC000828646164	603579140	/nfs/dbraw/zinc/57/91/40/603579140.db2.gz	GGMJCSOJWBJJBF-NYYWCZLTSA-N	-2	1	376.390	2.764	20	0		GFADML
CN(Cc1cc(Br)cn1C)C(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000828345401	604299686	/nfs/dbraw/zinc/29/96/86/604299686.db2.gz	BXMZNIVCJLRCMV-UHFFFAOYSA-N	-2	1	382.214	2.855	20	0		GFADML
Cc1ccc(-c2[nH]nc([N-]S(=O)(=O)c3c(C)oc(C)c3C(=O)[O-])c2C)o1	ZINC000832906966	604809461	/nfs/dbraw/zinc/80/94/61/604809461.db2.gz	HPFQGPBDQYFWKW-UHFFFAOYSA-N	-2	1	379.394	2.995	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc(C(=O)NC3CC3)c2)cc1Cl	ZINC000438789740	604990194	/nfs/dbraw/zinc/99/01/94/604990194.db2.gz	BXSACLYJSCPABF-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
CCC[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)cc2)cc1)C(=O)[O-]	ZINC000540785521	605022932	/nfs/dbraw/zinc/02/29/32/605022932.db2.gz	KBJRJTKVWOFMKO-MRXNPFEDSA-N	-2	1	394.424	2.610	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(=O)[O-])c1nc(C2CC2)no1	ZINC000563808668	605024193	/nfs/dbraw/zinc/02/41/93/605024193.db2.gz	XYTFSQQXKRKXLL-ZDUSSCGKSA-N	-2	1	399.856	2.974	20	0		GFADML
Cc1cc(Br)c([O-])c(NC(=O)CN(C[C@@H]2CCCO2)C(=O)[O-])c1	ZINC000833899193	605472471	/nfs/dbraw/zinc/47/24/71/605472471.db2.gz	ZTKDDCDSPAUEOT-JTQLQIEISA-N	-2	1	387.230	2.561	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(NC(=O)[O-])ccc2C)c(C)c1	ZINC000833879939	605991585	/nfs/dbraw/zinc/99/15/85/605991585.db2.gz	AVKNMXIIVOGMDE-UHFFFAOYSA-N	-2	1	378.406	2.981	20	0		GFADML
CC(C)[C@@H](C(=O)[O-])[C@@H](C)[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000819089367	660246131	/nfs/dbraw/zinc/24/61/31/660246131.db2.gz	OHXKNZHIAVPSRJ-GMSGAONNSA-N	-2	1	399.694	2.521	20	0		GFADML
N#Cc1cccc([N-]S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)c1	ZINC000013346004	654504815	/nfs/dbraw/zinc/50/48/15/654504815.db2.gz	LIQXMVVWLNJPHG-UHFFFAOYSA-N	-2	1	381.207	2.820	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc3oc(=O)[nH]c3c2)cc(C(=O)[O-])c1Cl	ZINC000759096362	655947382	/nfs/dbraw/zinc/94/73/82/655947382.db2.gz	WPKLWLXHNNZUAL-UHFFFAOYSA-N	-2	1	382.781	2.994	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(O)c2)cc(C(=O)[O-])c1Cl	ZINC000759103111	655947534	/nfs/dbraw/zinc/94/75/34/655947534.db2.gz	RZGPTRXJYBMGTL-UHFFFAOYSA-N	-3	1	385.781	2.551	20	0		GFADML
O=C(NOC/C=C/Cl)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000812405950	660026643	/nfs/dbraw/zinc/02/66/43/660026643.db2.gz	LGJSLPGOOUVJPV-QHHAFSJGSA-N	-2	1	388.854	2.668	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)C(=O)[O-]	ZINC000262469027	553171436	/nfs/dbraw/zinc/17/14/36/553171436.db2.gz	UCAHOFDQDSVVBN-VIFPVBQESA-N	-2	1	388.642	2.629	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)CCO3)ccc1Cl	ZINC000373248192	563332816	/nfs/dbraw/zinc/33/28/16/563332816.db2.gz	WXVAGACKHGATFH-UHFFFAOYSA-N	-2	1	381.793	2.804	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)ccc1Cl	ZINC000327384849	563458192	/nfs/dbraw/zinc/45/81/92/563458192.db2.gz	HBHMECOCNHZDMX-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(O)c2)cc1Cl	ZINC000436639969	563675744	/nfs/dbraw/zinc/67/57/44/563675744.db2.gz	NEZMHTYKVYJGBD-UHFFFAOYSA-N	-2	1	384.797	2.503	20	0		GFADML
O=C(Nc1nccs1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436755390	563678434	/nfs/dbraw/zinc/67/84/34/563678434.db2.gz	LYLRATZPRATLBD-UHFFFAOYSA-N	-2	1	381.460	2.963	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCC[C@@H]1CF	ZINC000293952131	563828532	/nfs/dbraw/zinc/82/85/32/563828532.db2.gz	DMOOMASVSIERAN-GFCCVEGCSA-N	-2	1	384.454	2.829	20	0		GFADML
O=S(=O)([N-]c1cccc(S(=O)(=O)[N-]c2ccccc2)c1)c1ccoc1	ZINC000506722191	564211064	/nfs/dbraw/zinc/21/10/64/564211064.db2.gz	PXZMBDUHZZAATP-UHFFFAOYSA-N	-2	1	378.431	2.881	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C(F)(F)F)c2)cn1	ZINC000507923865	564248294	/nfs/dbraw/zinc/24/82/94/564248294.db2.gz	VSJLCXNDHNDXHQ-UHFFFAOYSA-N	-2	1	376.312	2.608	20	0		GFADML
CSc1ccccc1S(=O)(=O)[N-]c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000479182278	564430191	/nfs/dbraw/zinc/43/01/91/564430191.db2.gz	CQYCGZRGQLSQRR-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
Cc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1C	ZINC000479434854	564439653	/nfs/dbraw/zinc/43/96/53/564439653.db2.gz	FYPLAWGSNFMHTM-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1nc(CCC[N-]S(=O)(=O)c2cc3ccccc3o2)sc1C(=O)[O-]	ZINC000547557135	564494213	/nfs/dbraw/zinc/49/42/13/564494213.db2.gz	HQFASRRXKHRDCA-UHFFFAOYSA-N	-2	1	380.447	2.807	20	0		GFADML
Cc1nc(C[N-]S(=O)(=O)c2cc(Cl)sc2Cl)ccc1C(=O)[O-]	ZINC000547564763	564495203	/nfs/dbraw/zinc/49/52/03/564495203.db2.gz	JDUABCHPPJFTMD-UHFFFAOYSA-N	-2	1	381.262	2.935	20	0		GFADML
C[C@]1(C(=O)[O-])CCC[C@H]1[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000548216564	564537771	/nfs/dbraw/zinc/53/77/71/564537771.db2.gz	HNVMEXHJZIXJHX-YPMHNXCESA-N	-2	1	398.225	2.649	20	0		GFADML
O=C([O-])CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2)cc1	ZINC000552892878	564704047	/nfs/dbraw/zinc/70/40/47/564704047.db2.gz	DAKHCKSYDJDJTG-UHFFFAOYSA-N	-2	1	382.825	2.944	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cc(O)cc(F)c2)cc1Br	ZINC000504244739	565036485	/nfs/dbraw/zinc/03/64/85/565036485.db2.gz	ANGFNRRCYSKRMF-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cc2c(cc1C(=O)[O-])OCCO2	ZINC000614764587	565132163	/nfs/dbraw/zinc/13/21/63/565132163.db2.gz	FQITXBGOVFZDMU-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)[N-]C[C@H](CCC(=O)[O-])C(F)(F)F)cc1F	ZINC000663293416	565407879	/nfs/dbraw/zinc/40/78/79/565407879.db2.gz	GNPIBZDSUGJVBG-QMMMGPOBSA-N	-2	1	375.315	2.595	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]C[C@@H](CCC(=O)[O-])C(F)(F)F)c(F)c1F	ZINC000629305481	565840344	/nfs/dbraw/zinc/84/03/44/565840344.db2.gz	UHNUFQVPQOBULB-MRVPVSSYSA-N	-2	1	375.315	2.595	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2c(O)cccc2F)c(Cl)cc1C(=O)[O-]	ZINC000674050164	565858118	/nfs/dbraw/zinc/85/81/18/565858118.db2.gz	IIEHZEFETGHELO-UHFFFAOYSA-N	-2	1	375.761	2.692	20	0		GFADML
CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2F)s1	ZINC000674049952	565858442	/nfs/dbraw/zinc/85/84/42/565858442.db2.gz	COHHAULDKJRTNW-QMMMGPOBSA-N	-2	1	386.426	2.583	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ncccc1C(F)(F)F)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653492843	565969058	/nfs/dbraw/zinc/96/90/58/565969058.db2.gz	AQAXACAYLPEZIR-INTQDDNPSA-N	-2	1	380.388	2.514	20	0		GFADML
Cc1c(Cl)ccc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2c(c1)CC(=O)N2	ZINC000681562555	566112339	/nfs/dbraw/zinc/11/23/39/566112339.db2.gz	WLFFRHZGENPDQZ-UHFFFAOYSA-N	-2	1	380.809	2.642	20	0		GFADML
CC(C)(C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)CC(=O)[O-]	ZINC000681576889	566114462	/nfs/dbraw/zinc/11/44/62/566114462.db2.gz	GVCROXLPOFDQKR-UHFFFAOYSA-N	-2	1	386.214	2.507	20	0		GFADML
O=C([O-])CCCCNC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-]	ZINC000821519414	598168907	/nfs/dbraw/zinc/16/89/07/598168907.db2.gz	HRTLCFIZCSIORL-UHFFFAOYSA-N	-2	1	392.358	2.907	20	0		GFADML
CC[C@H](NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)C1CCCCC1	ZINC000736916471	599703358	/nfs/dbraw/zinc/70/33/58/599703358.db2.gz	HOFXJFKNUNLQIF-SFHVURJKSA-N	-2	1	385.464	2.881	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)N(C)C(C)(C)C(=O)[O-])c2)cc1	ZINC000262461286	599848404	/nfs/dbraw/zinc/84/84/04/599848404.db2.gz	QTAWWRDCWVMBEU-UHFFFAOYSA-N	-2	1	390.461	2.731	20	0		GFADML
COc1ccc([C@H](NC(=O)c2cc(Br)ccc2[O-])C(=O)[O-])cc1	ZINC000737963477	599849962	/nfs/dbraw/zinc/84/99/62/599849962.db2.gz	WZODXEKYCKUFAP-AWEZNQCLSA-N	-2	1	380.194	2.719	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)N(C)CC(=O)[O-])c2)c1	ZINC000738312136	599852901	/nfs/dbraw/zinc/85/29/01/599852901.db2.gz	QDJCEQNNBHEUNA-UHFFFAOYSA-N	-2	1	396.852	2.606	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1C(=O)NC(C)C	ZINC000738633116	599908695	/nfs/dbraw/zinc/90/86/95/599908695.db2.gz	YLEATPPOHZRYIP-UHFFFAOYSA-N	-2	1	394.424	2.771	20	0		GFADML
O=C([O-])c1ccccc1S(=O)(=O)[N-]c1cccc(-c2n[nH]c(C3CC3)n2)c1	ZINC000740241119	599927446	/nfs/dbraw/zinc/92/74/46/599927446.db2.gz	OUCTUNUBHMCXBM-UHFFFAOYSA-N	-2	1	384.417	2.848	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(CSCC(=O)[O-])c2)cc1	ZINC000737702318	599927519	/nfs/dbraw/zinc/92/75/19/599927519.db2.gz	LNLAEAUIUIUDFM-UHFFFAOYSA-N	-2	1	395.458	2.592	20	0		GFADML
COC(=O)c1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cccc([C@@H](C)OC)c2)c1	ZINC000737654870	599981689	/nfs/dbraw/zinc/98/16/89/599981689.db2.gz	WPHVXJSFZIHJOB-LLVKDONJSA-N	-2	1	393.417	2.680	20	0		GFADML
C[C@H]1c2ccccc2CCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736840529	600075465	/nfs/dbraw/zinc/07/54/65/600075465.db2.gz	NXMZEVWJBBDSKK-AWEZNQCLSA-N	-2	1	391.427	2.552	20	0		GFADML
CCOC(=O)/C=C\c1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000737137473	600093978	/nfs/dbraw/zinc/09/39/78/600093978.db2.gz	VCNRXYGKFBILQB-YHYXMXQVSA-N	-2	1	393.392	2.901	20	0		GFADML
CCOc1cc([N-]S(=O)(=O)c2cc(C(=O)OC)ccc2C(=O)[O-])ccc1C	ZINC000737192096	600100009	/nfs/dbraw/zinc/10/00/09/600100009.db2.gz	ROFOESZBSGOAOJ-UHFFFAOYSA-N	-2	1	393.417	2.679	20	0		GFADML
O=C([O-])c1cc2ccccc2cc1[N-]S(=O)(=O)c1ccc2c(c1)C(=O)NCC2	ZINC000734806463	600210992	/nfs/dbraw/zinc/21/09/92/600210992.db2.gz	BANMNGSEOKDJGK-UHFFFAOYSA-N	-2	1	396.424	2.625	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(N3CCCCC3)nc2)cc1C(=O)[O-]	ZINC000832955869	600828526	/nfs/dbraw/zinc/82/85/26/600828526.db2.gz	PHUUFWDLDKPZKD-UHFFFAOYSA-N	-2	1	375.450	2.879	20	0		GFADML
Cc1noc(C)c1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1Br	ZINC000071392888	600830298	/nfs/dbraw/zinc/83/02/98/600830298.db2.gz	FRHRWZWDHUXPFA-UHFFFAOYSA-N	-2	1	375.200	2.553	20	0		GFADML
CN(C)C(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)c1	ZINC000484967672	600898737	/nfs/dbraw/zinc/89/87/37/600898737.db2.gz	REENVDXTYFXXRR-UHFFFAOYSA-N	-2	1	390.461	2.551	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCC(C4CCCC4)CC3)cc2)[n-]1	ZINC000833264656	600918805	/nfs/dbraw/zinc/91/88/05/600918805.db2.gz	HINSOCVMYCUHLQ-UHFFFAOYSA-N	-2	1	397.475	2.835	20	0		GFADML
C[C@H]1CN(c2ccc([N-]S(=O)(=O)c3csc(C(=O)[O-])c3)cc2)C[C@H](C)O1	ZINC000747407973	600980810	/nfs/dbraw/zinc/98/08/10/600980810.db2.gz	KDVQFUFIFYRFEO-RYUDHWBXSA-N	-2	1	396.490	2.861	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)CCOc2ccc(F)cc2)c(F)cc1F	ZINC000740087379	601048319	/nfs/dbraw/zinc/04/83/19/601048319.db2.gz	ALTGGBLPTLWCCR-UHFFFAOYSA-N	-2	1	375.324	2.623	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3ccc(/C=C\C(=O)[O-])cc3)ccc2o1	ZINC000831831582	601229994	/nfs/dbraw/zinc/22/99/94/601229994.db2.gz	MHEXFGXRNJJZBN-WTKPLQERSA-N	-2	1	388.401	2.873	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)[O-])c(F)cc1F	ZINC000830232234	601250480	/nfs/dbraw/zinc/25/04/80/601250480.db2.gz	KGUBABSTBMYLSW-UHFFFAOYSA-N	-2	1	385.344	2.724	20	0		GFADML
CC(C)CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000055639680	601323699	/nfs/dbraw/zinc/32/36/99/601323699.db2.gz	KHXAYBPWFIQQED-UHFFFAOYSA-N	-2	1	394.424	2.711	20	0		GFADML
Cc1cc(F)cc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(/C=C/C(=O)[O-])cc1	ZINC000832887541	601327582	/nfs/dbraw/zinc/32/75/82/601327582.db2.gz	KCKVFDRJDREKOU-QPJJXVBHSA-N	-3	1	379.365	2.731	20	0		GFADML
COC(=O)/C=C\c1ccc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])cc1	ZINC000747607724	601330586	/nfs/dbraw/zinc/33/05/86/601330586.db2.gz	BYSSGOQALYXNPR-YFHOEESVSA-N	-2	1	379.365	2.511	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(S(C)(=O)=O)cc2C)c1C	ZINC000522253249	601330805	/nfs/dbraw/zinc/33/08/05/601330805.db2.gz	ICZUDLUKTSTYBU-UHFFFAOYSA-N	-2	1	397.474	2.514	20	0		GFADML
C/C(=C\COC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1)C(=O)[O-]	ZINC000825780669	601406524	/nfs/dbraw/zinc/40/65/24/601406524.db2.gz	GPFCVJXODUASGX-ACCUITESSA-N	-2	1	375.402	2.675	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2cc(-c3cccc(Cl)c3)n[nH]2)cc1C(=O)[O-]	ZINC000754840117	601605265	/nfs/dbraw/zinc/60/52/65/601605265.db2.gz	KRSOKKLGFJRTHO-UHFFFAOYSA-N	-2	1	380.813	2.568	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)N[C@H](c1ccccc1)[C@H](C)C(=O)[O-]	ZINC000833003990	601608526	/nfs/dbraw/zinc/60/85/26/601608526.db2.gz	DWNQMBLVFVJQPW-YUNKPMOVSA-N	-2	1	396.447	2.563	20	0		GFADML
C[C@@H]1Oc2ccc([N-]S(=O)(=O)c3ccc(Cl)c(C(=O)[O-])c3)cc2NC1=O	ZINC000013032957	601826469	/nfs/dbraw/zinc/82/64/69/601826469.db2.gz	RBFVKUHYCQDHTR-QMMMGPOBSA-N	-2	1	396.808	2.558	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(NC(=O)C3CC3)cc2)cc(F)c1F	ZINC000751146545	601832166	/nfs/dbraw/zinc/83/21/66/601832166.db2.gz	NQBNOROFNZRYRR-UHFFFAOYSA-N	-2	1	396.371	2.812	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])ccc2o1	ZINC000831796035	601847742	/nfs/dbraw/zinc/84/77/42/601847742.db2.gz	YLQUJUKJFSJEHB-UHFFFAOYSA-N	-2	1	394.380	2.655	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(C(C)(C)C(=O)[O-])cc1	ZINC000477432615	601985738	/nfs/dbraw/zinc/98/57/38/601985738.db2.gz	YCUNLSIRQQGLHS-UHFFFAOYSA-N	-3	1	377.418	2.856	20	0		GFADML
COC(=O)Cc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000580687101	601988215	/nfs/dbraw/zinc/98/82/15/601988215.db2.gz	ASFUYHGWHYBHPP-UHFFFAOYSA-N	-2	1	377.418	2.518	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)N[C@H](C)C(=O)[O-])c2)c1	ZINC000738311399	602243529	/nfs/dbraw/zinc/24/35/29/602243529.db2.gz	GXUQSTXWNOCLGU-LLVKDONJSA-N	-2	1	396.852	2.652	20	0		GFADML
O=C([O-])c1ccc(C(F)(F)F)cc1S(=O)(=O)[N-]c1cc(C2CC2)n[nH]1	ZINC000833311692	602307361	/nfs/dbraw/zinc/30/73/61/602307361.db2.gz	ASFPBMACQIOTEW-UHFFFAOYSA-N	-2	1	375.328	2.805	20	0		GFADML
CC(C)N(CCCNC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)C(=O)[O-]	ZINC000738849909	602423832	/nfs/dbraw/zinc/42/38/32/602423832.db2.gz	UNAPGMAPZPFBIO-UHFFFAOYSA-N	-2	1	391.468	2.775	20	0		GFADML
CCN(Cc1cccc([N-]S(=O)(=O)c2cccc3c2COC3=O)c1)C(=O)[O-]	ZINC000739448806	602654268	/nfs/dbraw/zinc/65/42/68/602654268.db2.gz	YIQOJALTCWVAKT-UHFFFAOYSA-N	-2	1	390.417	2.658	20	0		GFADML
CC(C)(C)OC(=O)N[C@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738718546	602852665	/nfs/dbraw/zinc/85/26/65/602852665.db2.gz	YJSHXVVDTBERGD-LBPRGKRZSA-N	-2	1	379.413	2.611	20	0		GFADML
CSc1nc(C)c(CCC(=O)Oc2ccc(N(C)C(=O)[O-])cc2)c(=O)[n-]1	ZINC000829778235	603044983	/nfs/dbraw/zinc/04/49/83/603044983.db2.gz	VPARTEWWJJRWSE-UHFFFAOYSA-N	-2	1	377.422	2.865	20	0		GFADML
O=C([O-])NC[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)C1CC1	ZINC000740614389	603071963	/nfs/dbraw/zinc/07/19/63/603071963.db2.gz	ROOMIHUNFYWNPS-SNVBAGLBSA-N	-2	1	387.672	2.971	20	0		GFADML
O=C([O-])N(CC[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C1CC1	ZINC000740488175	603086139	/nfs/dbraw/zinc/08/61/39/603086139.db2.gz	GMTIRZKTKKBVTJ-UHFFFAOYSA-N	-2	1	386.779	2.780	20	0		GFADML
CCN(CC1CCN(C(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)CC1)C(=O)[O-]	ZINC000827080166	603500708	/nfs/dbraw/zinc/50/07/08/603500708.db2.gz	QGHIVINTOGGIOJ-UHFFFAOYSA-N	-2	1	378.473	2.640	20	0		GFADML
CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000827927535	603608501	/nfs/dbraw/zinc/60/85/01/603608501.db2.gz	RKAZSHNHGLJKDZ-LBPRGKRZSA-N	-2	1	379.413	2.564	20	0		GFADML
CC(C)CC[C@H]1CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000826845776	604342295	/nfs/dbraw/zinc/34/22/95/604342295.db2.gz	ZJYBJZWUESFSQU-QGZVFWFLSA-N	-2	1	385.464	2.834	20	0		GFADML
CC(C)C(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(F)cc2C(=O)[O-])c1	ZINC000833466247	604744652	/nfs/dbraw/zinc/74/46/52/604744652.db2.gz	AZMZTXFQSCHWME-UHFFFAOYSA-N	-2	1	380.397	2.919	20	0		GFADML
CC(C)CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)cc2C(=O)[O-])cc1	ZINC000833488006	604744755	/nfs/dbraw/zinc/74/47/55/604744755.db2.gz	FJYXOBKTTMNZPQ-UHFFFAOYSA-N	-2	1	394.424	2.711	20	0		GFADML
Cc1nnc(-c2cccc([N-]S(=O)(=O)c3cccc(C(=O)[O-])c3C)c2)n1C	ZINC000378196849	604792440	/nfs/dbraw/zinc/79/24/40/604792440.db2.gz	RELBSORPRDJVRG-UHFFFAOYSA-N	-2	1	386.433	2.598	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ncccc2Br)c1C	ZINC000316054821	604797132	/nfs/dbraw/zinc/79/71/32/604797132.db2.gz	XRUVACKXECOZLO-UHFFFAOYSA-N	-2	1	385.239	2.960	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCO3)c(OC)c1C(=O)[O-]	ZINC000833734506	604862001	/nfs/dbraw/zinc/86/20/01/604862001.db2.gz	JAHKYEIBPYICIN-UHFFFAOYSA-N	-2	1	393.417	2.528	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NC3CC3)cc2)cc1Cl	ZINC000438799880	604991146	/nfs/dbraw/zinc/99/11/46/604991146.db2.gz	ZXXXPAPPVBGEEG-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
CCC[C@@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)cc1)C(=O)[O-]	ZINC000680364207	605023023	/nfs/dbraw/zinc/02/30/23/605023023.db2.gz	LKQFNMJNNJFUDP-MRXNPFEDSA-N	-2	1	394.424	2.610	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C(=O)[O-])cc1NC(C)=O	ZINC000833733131	605168312	/nfs/dbraw/zinc/16/83/12/605168312.db2.gz	HUURAUPZKZGDHE-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)OCc2ccc(NC(=O)[O-])cc2)o1	ZINC000833431437	605304592	/nfs/dbraw/zinc/30/45/92/605304592.db2.gz	YIFQXDSVKMKALG-UHFFFAOYSA-N	-2	1	396.421	2.803	20	0		GFADML
C[C@H](Oc1cccc(Br)c1)C(=O)N[N-]C(=O)c1c([O-])cccc1F	ZINC000163812359	655136141	/nfs/dbraw/zinc/13/61/41/655136141.db2.gz	KOUHWKPVCZUGFH-VIFPVBQESA-N	-2	1	397.200	2.522	20	0		GFADML
Cc1cc(S(=O)(=O)[N-][C@@H](CC(F)(F)F)C(=O)[O-])sc1Br	ZINC000275326149	655229673	/nfs/dbraw/zinc/22/96/73/655229673.db2.gz	SXGDIPXTCSCHEK-YFKPBYRVSA-N	-2	1	396.206	2.503	20	0		GFADML
O=C([O-])[C@H]1C=C[C@@H]([N-]S(=O)(=O)c2c(Cl)cc(F)cc2Br)C1	ZINC000275040054	655213204	/nfs/dbraw/zinc/21/32/04/655213204.db2.gz	QYSVJSFNEKBBHR-POYBYMJQSA-N	-2	1	398.637	2.549	20	0		GFADML
C[C@@]1(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CC1(Cl)Cl	ZINC000840894796	661201830	/nfs/dbraw/zinc/20/18/30/661201830.db2.gz	VMFYVRINMLKNJT-GFCCVEGCSA-N	-2	1	388.219	2.915	20	0		GFADML
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2O)cc(C(=O)[O-])c1Cl	ZINC000759090196	655946915	/nfs/dbraw/zinc/94/69/15/655946915.db2.gz	NAGWSOLYRKIOJK-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
C[C@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F)Cc1cccs1	ZINC000761308354	656009918	/nfs/dbraw/zinc/00/99/18/656009918.db2.gz	RAJNDDHYRORXHA-VIFPVBQESA-N	-2	1	375.418	2.882	20	0		GFADML
Cc1nc2cc([N-]S(=O)(=O)c3ccc(OCC(=O)[O-])cc3)ccc2s1	ZINC000781121389	657043574	/nfs/dbraw/zinc/04/35/74/657043574.db2.gz	ZLEUDTYHQJHTID-UHFFFAOYSA-N	-2	1	378.431	2.869	20	0		GFADML
CO[C@@H]1Cc2ccc([N-]S(=O)(=O)c3ccc(C(=O)[O-])c(Cl)c3)cc2C1	ZINC000783860437	657265729	/nfs/dbraw/zinc/26/57/29/657265729.db2.gz	ZBRMTZPJQQBWPQ-CYBMUJFWSA-N	-2	1	381.837	2.953	20	0		GFADML
COc1cc(Cl)c(S(=O)(=O)[N-]c2c(C)n[nH]c2C(F)F)cc1C(=O)[O-]	ZINC000790405302	657970236	/nfs/dbraw/zinc/97/02/36/657970236.db2.gz	QBKZPMUTJJQELJ-UHFFFAOYSA-N	-2	1	395.771	2.817	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-][C@@H](C)CCCCC(=O)[O-])c(F)cc1Cl	ZINC000794762856	658609682	/nfs/dbraw/zinc/60/96/82/658609682.db2.gz	PVNHKFFBEYUINE-VIFPVBQESA-N	-2	1	395.836	2.578	20	0		GFADML
Cc1cc(C(N)=O)ccc1[N-]S(=O)(=O)c1cc(Cl)c(C)c(C(=O)[O-])c1	ZINC000794864285	658628226	/nfs/dbraw/zinc/62/82/26/658628226.db2.gz	NFIVPVPAYKYXOP-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
COc1cc(C)[n-]c(=N[N-]S(=O)(=O)c2c(Cl)cc(F)cc2Cl)n1	ZINC000797816241	659053596	/nfs/dbraw/zinc/05/35/96/659053596.db2.gz	MDZNRBUMUBBNJK-UHFFFAOYSA-N	-2	1	381.216	2.545	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@@H]([N-]S(=O)(=O)c1cc3ccccc3o1)CCS2	ZINC000899948092	663703489	/nfs/dbraw/zinc/70/34/89/663703489.db2.gz	FBMKPRUUOYKNGF-JZLYGMAVSA-N	-2	1	381.475	2.840	20	0		GFADML
C[C@@]1(C(=O)[O-])C[C@@H]([N-]S(=O)(=O)c2sc3ccccc3c2Cl)CCO1	ZINC000906011279	663908541	/nfs/dbraw/zinc/90/85/41/663908541.db2.gz	RHCXHZCCQAYVMJ-VFZGTOFNSA-N	-2	1	389.882	2.855	20	0		GFADML
CCC[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)C(=O)[O-]	ZINC000262464909	553171175	/nfs/dbraw/zinc/17/11/75/553171175.db2.gz	STAQIXZPFOWSDH-SECBINFHSA-N	-2	1	388.642	2.773	20	0		GFADML
C[C@@H]1C(=O)Nc2ccc(S(=O)(=O)[N-]c3cccc(Cl)c3C(=O)[O-])cc21	ZINC000327441989	563458211	/nfs/dbraw/zinc/45/82/11/563458211.db2.gz	RFOJPSOSCZLYSO-QMMMGPOBSA-N	-2	1	380.809	2.895	20	0		GFADML
CNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000327679203	563459494	/nfs/dbraw/zinc/45/94/94/563459494.db2.gz	MUMGIRLAZHPCRA-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc(F)c(C(=O)[O-])c1	ZINC000392755610	563527012	/nfs/dbraw/zinc/52/70/12/563527012.db2.gz	DLIQFUUUVYRVEV-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)OC(F)(F)O3)cc1F	ZINC000392999830	563527906	/nfs/dbraw/zinc/52/79/06/563527906.db2.gz	LGBHVUHGGBUIKH-UHFFFAOYSA-N	-2	1	375.280	2.646	20	0		GFADML
NC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])c1	ZINC000410369236	563587845	/nfs/dbraw/zinc/58/78/45/563587845.db2.gz	APLXAYDAUFUVDS-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
COC(=O)c1ccccc1[N-]S(=O)(=O)c1cc(C(F)(F)F)ccc1[O-]	ZINC000436476007	563671120	/nfs/dbraw/zinc/67/11/20/563671120.db2.gz	IGEVQSORPYCDMS-UHFFFAOYSA-N	-2	1	375.324	2.998	20	0		GFADML
COc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)[O-])c(Cl)c1	ZINC000438766215	563710669	/nfs/dbraw/zinc/71/06/69/563710669.db2.gz	WJLXLRADKFUUSS-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)COC3)cc1Cl	ZINC000507022932	564216081	/nfs/dbraw/zinc/21/60/81/564216081.db2.gz	VTXDIRJLAHKGOS-UHFFFAOYSA-N	-2	1	383.809	2.634	20	0		GFADML
COC(=O)c1ccc(Cl)cc1S(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1F	ZINC000509663319	564309157	/nfs/dbraw/zinc/30/91/57/564309157.db2.gz	GVYSOXBMPUIYJU-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1)c1nc(C(C)(C)C)no1	ZINC000567382498	564368736	/nfs/dbraw/zinc/36/87/36/564368736.db2.gz	IBSIXBSHGBGYJM-MRVPVSSYSA-N	-2	1	387.845	2.758	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1C[S@@](C)=O	ZINC000547241989	564480391	/nfs/dbraw/zinc/48/03/91/564480391.db2.gz	CGGMJXRTNIQVCB-XMMPIXPASA-N	-2	1	385.438	2.512	20	0		GFADML
O=C([O-])[C@@H](Cc1cccc(Cl)c1)[N-]S(=O)(=O)c1cc(F)c(F)cc1F	ZINC000548570698	564562499	/nfs/dbraw/zinc/56/24/99/564562499.db2.gz	UXNMKLMBAWYFSX-CYBMUJFWSA-N	-2	1	393.770	2.732	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(=O)[O-])c1nc(C(C)(C)C)no1	ZINC000518972030	564566280	/nfs/dbraw/zinc/56/62/80/564566280.db2.gz	HWQMAPZFBAUBRV-MRVPVSSYSA-N	-2	1	387.845	2.758	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1cc(Cl)ccc1Cl)C(F)(F)F	ZINC000551997542	564672691	/nfs/dbraw/zinc/67/26/91/564672691.db2.gz	NYJWEJWYCDUNAQ-ZCFIWIBFSA-N	-2	1	380.171	2.925	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cccc(C[S@](C)=O)c2)c1C	ZINC000524549826	564682959	/nfs/dbraw/zinc/68/29/59/564682959.db2.gz	REDBGTGELMJUQU-DEOSSOPVSA-N	-2	1	381.475	2.681	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2C)c1	ZINC000525015885	564691888	/nfs/dbraw/zinc/69/18/88/564691888.db2.gz	QOHJOCNYJMHMRI-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F)C(F)F	ZINC000554785857	564773594	/nfs/dbraw/zinc/77/35/94/564773594.db2.gz	MSNQPEKJFDFLTR-ZCFIWIBFSA-N	-2	1	395.733	2.993	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2cc(F)cc(F)c2)cc1Cl	ZINC000500299630	564949814	/nfs/dbraw/zinc/94/98/14/564949814.db2.gz	AUQXSLXETMPYOK-UHFFFAOYSA-N	-2	1	377.752	2.882	20	0		GFADML
COC(=O)[C@H](C)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)c1	ZINC000560881489	564979326	/nfs/dbraw/zinc/97/93/26/564979326.db2.gz	YHMQUZMWQWMEIX-SECBINFHSA-N	-2	1	383.447	2.832	20	0		GFADML
Cc1nc(S(=O)(=O)[N-][C@@H](CC(F)F)C(=O)[O-])c(-c2ccccc2)s1	ZINC000663287018	565406541	/nfs/dbraw/zinc/40/65/41/565406541.db2.gz	VKHWDUCTGXFZEL-JTQLQIEISA-N	-2	1	376.406	2.505	20	0		GFADML
C[C@@H]1CCc2[n-]n(-c3ccc(S(=O)(=O)[N-]c4nccs4)cc3)c(=O)c21	ZINC000634616976	566160700	/nfs/dbraw/zinc/16/07/00/566160700.db2.gz	CBGKYMGXDOORPG-YGRLFVJLSA-N	-2	1	376.463	2.693	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)N(C)CCC(=O)[O-])cc2)c1C	ZINC000262998583	597006153	/nfs/dbraw/zinc/00/61/53/597006153.db2.gz	PKKMAGVATQGZEE-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
CCN(CC)C(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2CC(=O)[O-])cc1	ZINC000818193799	597314913	/nfs/dbraw/zinc/31/49/13/597314913.db2.gz	UBGGIAVMCBYZAU-UHFFFAOYSA-N	-2	1	390.461	2.597	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)NCCCCC(=O)[O-])cc2)cc1	ZINC000262027389	598165553	/nfs/dbraw/zinc/16/55/53/598165553.db2.gz	BDFPJZGBWBBMBG-UHFFFAOYSA-N	-2	1	390.461	2.781	20	0		GFADML
O=C([O-])CSCCC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000739850978	599746761	/nfs/dbraw/zinc/74/67/61/599746761.db2.gz	AMMLPOUQEZOODQ-UHFFFAOYSA-N	-2	1	394.474	2.634	20	0		GFADML
C[C@H]1Cc2ccccc2N(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736823145	599773915	/nfs/dbraw/zinc/77/39/15/599773915.db2.gz	AQTZYTLHTLJZET-AWEZNQCLSA-N	-2	1	391.427	2.632	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)NC[C@@H](C)C(=O)[O-])c2)c1	ZINC000262479680	599778267	/nfs/dbraw/zinc/77/82/67/599778267.db2.gz	DBVBBIDMRQMSTJ-CQSZACIVSA-N	-2	1	390.461	2.555	20	0		GFADML
COC(=O)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cl)c1F	ZINC000737718512	599814862	/nfs/dbraw/zinc/81/48/62/599814862.db2.gz	SXPHKPZDLLCGBB-UHFFFAOYSA-N	-2	1	393.801	2.826	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])c2cccnc12	ZINC000516332511	599851973	/nfs/dbraw/zinc/85/19/73/599851973.db2.gz	IWWOAQNXALXACK-UHFFFAOYSA-N	-2	1	376.365	2.882	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)NC(C)C)c(C)c1	ZINC000521751507	599908062	/nfs/dbraw/zinc/90/80/62/599908062.db2.gz	XWTWGNZDFXRCGS-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
CCCN(CC(=O)[O-])C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)cc1	ZINC000544614289	600022961	/nfs/dbraw/zinc/02/29/61/600022961.db2.gz	DVSKBGNVXYFLCE-UHFFFAOYSA-N	-2	1	394.424	2.563	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1cccc(Oc2cnccn2)c1	ZINC000740143586	600096162	/nfs/dbraw/zinc/09/61/62/600096162.db2.gz	GRHOARPUCNTOLS-UHFFFAOYSA-N	-2	1	389.364	2.907	20	0		GFADML
CC[C@@]([N-]S(=O)(=O)c1c(F)cc(OC)cc1F)(C(=O)[O-])c1ccccc1	ZINC000736920768	600136600	/nfs/dbraw/zinc/13/66/00/600136600.db2.gz	RYNHXTFCGCHPPE-KRWDZBQOSA-N	-2	1	385.388	2.642	20	0		GFADML
CC(C)n1cc2cc([N-]S(=O)(=O)c3ccc(OCC(=O)[O-])cc3)ccc2n1	ZINC000438754239	600244498	/nfs/dbraw/zinc/24/44/98/600244498.db2.gz	JUIBAIOXGZBWJC-UHFFFAOYSA-N	-2	1	389.433	2.881	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(-c2nc[nH]n2)c1	ZINC000740133756	600392436	/nfs/dbraw/zinc/39/24/36/600392436.db2.gz	CVEFTYUPUIWWKJ-UHFFFAOYSA-N	-2	1	378.797	2.624	20	0		GFADML
CCOC(=O)CCc1ccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])cc1	ZINC000737138721	600545618	/nfs/dbraw/zinc/54/56/18/600545618.db2.gz	QDWNHZXAGKPDOE-UHFFFAOYSA-N	-2	1	377.418	2.681	20	0		GFADML
Cc1ccc(NC(=O)C2CC2)cc1[N-]S(=O)(=O)c1ccc(CC(=O)[O-])cc1	ZINC000267201086	600626236	/nfs/dbraw/zinc/62/62/36/600626236.db2.gz	QKOWKIWKFKZCGQ-UHFFFAOYSA-N	-2	1	388.445	2.771	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ccccc1F)c1nc(-c2cccc(C(=O)[O-])c2)no1	ZINC000827759839	600700179	/nfs/dbraw/zinc/70/01/79/600700179.db2.gz	AQDLTQKEDVPTFE-SNVBAGLBSA-N	-2	1	391.380	2.613	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2ccc3c(c2)OC2(CCCC2)O3)cc1C(=O)[O-]	ZINC000298235383	600809661	/nfs/dbraw/zinc/80/96/61/600809661.db2.gz	FYLLPOHCNKAYDH-UHFFFAOYSA-N	-2	1	378.406	2.566	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc3ncccc3c2)c(C(=O)[O-])cc1OC	ZINC000525530953	600887008	/nfs/dbraw/zinc/88/70/08/600887008.db2.gz	GLIRNKBTXUNEOX-UHFFFAOYSA-N	-2	1	388.401	2.751	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCCO3)cc1	ZINC000265750704	600898721	/nfs/dbraw/zinc/89/87/21/600898721.db2.gz	JFQJABHRBLPUDM-UHFFFAOYSA-N	-2	1	377.418	2.621	20	0		GFADML
O=C([O-])c1ccc(Cl)c(S(=O)(=O)Nc2cc(F)c(C(=O)[O-])c(F)c2)c1	ZINC000740136862	601118753	/nfs/dbraw/zinc/11/87/53/601118753.db2.gz	ZKFFLSIULJOJCN-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
Cc1oc(S(=O)(=O)[N-]c2ccc3nc([C@H]4CCCO4)[nH]c3c2)cc1C(=O)[O-]	ZINC000833030360	601233319	/nfs/dbraw/zinc/23/33/19/601233319.db2.gz	UDULEWCIWRTNQE-CQSZACIVSA-N	-2	1	391.405	2.815	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)CS3)c1C	ZINC000013032313	601319957	/nfs/dbraw/zinc/31/99/57/601319957.db2.gz	MCFRLBKHRADQDF-UHFFFAOYSA-N	-2	1	392.458	2.847	20	0		GFADML
COC(=O)/C=C/c1ccc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2C)cc1	ZINC000747613633	601322259	/nfs/dbraw/zinc/32/22/59/601322259.db2.gz	SHCUWWXVCOLKBU-DHZHZOJOSA-N	-2	1	375.402	2.680	20	0		GFADML
COC(=O)c1cc2cc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)ccc2o1	ZINC000055610360	601322806	/nfs/dbraw/zinc/32/28/06/601322806.db2.gz	JDRRFWFIXKFHPQ-UHFFFAOYSA-N	-2	1	393.348	2.858	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])cc2)c1	ZINC000831247579	601324909	/nfs/dbraw/zinc/32/49/09/601324909.db2.gz	CVVLHDAOBMNRNE-UHFFFAOYSA-N	-2	1	378.406	2.981	20	0		GFADML
CC(C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1	ZINC000826976433	601326316	/nfs/dbraw/zinc/32/63/16/601326316.db2.gz	YAAFANKHFQHBBJ-XGICHPGQSA-N	-2	1	388.445	2.723	20	0		GFADML
Cc1cc(C)c(C(=O)[O-])c([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000832871951	601335620	/nfs/dbraw/zinc/33/56/20/601335620.db2.gz	FBWJLDBEDSXKDZ-YVMONPNESA-N	-3	1	375.402	2.900	20	0		GFADML
O=C([O-])c1nc(Cl)ccc1S(=O)(=O)[N-]c1ccc(N2CCCC2)c(F)c1	ZINC000833344752	601384651	/nfs/dbraw/zinc/38/46/51/601384651.db2.gz	IOPOJOHLGHMQHJ-UHFFFAOYSA-N	-2	1	399.831	2.973	20	0		GFADML
NC(=O)c1ccc([N-]S(=O)(=O)c2c3ccccc3sc2C(=O)[O-])c(F)c1	ZINC000833085923	601387995	/nfs/dbraw/zinc/38/79/95/601387995.db2.gz	COEXUJWGKCHESO-UHFFFAOYSA-N	-2	1	394.405	2.638	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl)C(=O)[O-]	ZINC000035085775	601572609	/nfs/dbraw/zinc/57/26/09/601572609.db2.gz	GXTYMSOTWQXUSY-MRVPVSSYSA-N	-2	1	391.070	2.897	20	0		GFADML
CCCc1ccc(-c2cc([N-]S(=O)(=O)c3n[nH]c(C)c3C(=O)[O-])n[nH]2)cc1	ZINC000829567069	601604442	/nfs/dbraw/zinc/60/44/42/601604442.db2.gz	XQDDTYALHOKAQE-UHFFFAOYSA-N	-2	1	389.437	2.560	20	0		GFADML
CC[C@@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(C)c2)cc1)C(=O)[O-]	ZINC000584284791	601748928	/nfs/dbraw/zinc/74/89/28/601748928.db2.gz	VYNAAXSLHNGNOV-QGZVFWFLSA-N	-2	1	390.461	2.697	20	0		GFADML
CC[C@@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1)C(=O)[O-]	ZINC000568158533	601750382	/nfs/dbraw/zinc/75/03/82/601750382.db2.gz	OGUBWKDLIAMAMV-OAHLLOKOSA-N	-2	1	396.852	2.734	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CCC(=O)N[C@@H](C(=O)[O-])C1CCCCC1	ZINC000832993111	601786805	/nfs/dbraw/zinc/78/68/05/601786805.db2.gz	KLCNPUKPBPXRGF-GOSISDBHSA-N	-2	1	398.463	2.635	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)CS3)ccc1Cl	ZINC000013032293	601826380	/nfs/dbraw/zinc/82/63/80/601826380.db2.gz	PSUMDMINHUTZHI-UHFFFAOYSA-N	-2	1	398.849	2.883	20	0		GFADML
CCOC(=O)c1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1	ZINC000751141790	601829884	/nfs/dbraw/zinc/82/98/84/601829884.db2.gz	IQHJJQSAONYYCV-UHFFFAOYSA-N	-2	1	385.344	2.641	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(-n2ccnc2)c(F)c1	ZINC000833293862	601847912	/nfs/dbraw/zinc/84/79/12/601847912.db2.gz	BMQPEEDHMUMLGU-UHFFFAOYSA-N	-2	1	379.344	2.650	20	0		GFADML
CC(=O)N1CCCc2cc([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])ccc21	ZINC000825834710	601860582	/nfs/dbraw/zinc/86/05/82/601860582.db2.gz	UJOYHZOSXDFGOH-UHFFFAOYSA-N	-2	1	392.408	2.624	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)cc1OCC	ZINC000462099950	601986710	/nfs/dbraw/zinc/98/67/10/601986710.db2.gz	TZMNUPFWWNZPNS-UHFFFAOYSA-N	-2	1	379.434	2.912	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)cc1	ZINC000737829125	601988006	/nfs/dbraw/zinc/98/80/06/601988006.db2.gz	LEVUXWFUULUIEV-UHFFFAOYSA-N	-2	1	377.418	2.681	20	0		GFADML
C[C@H](CC(=O)[O-])C(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(F)c(F)c2)cc1	ZINC000827310495	602073400	/nfs/dbraw/zinc/07/34/00/602073400.db2.gz	JVFRMFPTLOBEHZ-SNVBAGLBSA-N	-2	1	398.387	2.815	20	0		GFADML
Cc1ccc(NC(=O)[C@H](C)CC(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1	ZINC000832942059	602096499	/nfs/dbraw/zinc/09/64/99/602096499.db2.gz	AKTAXLLOGZTWPL-CYBMUJFWSA-N	-2	1	376.434	2.845	20	0		GFADML
CC(C)C[C@@H]1CCCN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000826831810	602322151	/nfs/dbraw/zinc/32/21/51/602322151.db2.gz	HNNQVQMIEKFHRJ-HNNXBMFYSA-N	-2	1	385.464	2.691	20	0		GFADML
CC(C)C[C@@H](NC(=O)[O-])c1noc([C@H](C)[N-]S(=O)(=O)c2cccs2)n1	ZINC000738817946	602408453	/nfs/dbraw/zinc/40/84/53/602408453.db2.gz	VTDNQHUCAIUSOK-VHSXEESVSA-N	-2	1	388.471	2.525	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCN(c3cccc(F)c3F)CC2)c([O-])c1	ZINC000740697016	602866566	/nfs/dbraw/zinc/86/65/66/602866566.db2.gz	DLTYQRHXEGOGQE-UHFFFAOYSA-N	-2	1	377.347	2.723	20	0		GFADML
COc1ccc(NC(=O)c2ccc(C)c(NC(=O)[O-])c2)cc1[N-]S(C)(=O)=O	ZINC000829474678	603290015	/nfs/dbraw/zinc/29/00/15/603290015.db2.gz	METDYYKPNMAPND-UHFFFAOYSA-N	-2	1	393.421	2.717	20	0		GFADML
C[C@@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2cccc(C(=O)N(C)C)c2)cc1	ZINC000825449765	603400453	/nfs/dbraw/zinc/40/04/53/603400453.db2.gz	YPYNEYGLJUOJKK-GFCCVEGCSA-N	-2	1	391.449	2.518	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@H]2CCC[C@@H]2CNC(=O)[O-])c([O-])c1	ZINC000823827977	603910369	/nfs/dbraw/zinc/91/03/69/603910369.db2.gz	NFCJDMZGTNCPMS-RISCZKNCSA-N	-2	1	393.440	2.905	20	0		GFADML
CCC[C@@H](C)[C@@H]1CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829208095	604342585	/nfs/dbraw/zinc/34/25/85/604342585.db2.gz	IKQJLFKTFMZTJO-KDOFPFPSSA-N	-2	1	385.464	2.834	20	0		GFADML
O=C([O-])c1sccc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(C(F)(F)F)c1	ZINC000833321345	604400154	/nfs/dbraw/zinc/40/01/54/604400154.db2.gz	ARVBGSPSPCVOFO-UHFFFAOYSA-N	-3	1	395.336	2.964	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)OC2CCC(CC(=O)[O-])CC2)o1	ZINC000833431448	604496925	/nfs/dbraw/zinc/49/69/25/604496925.db2.gz	ZAGAWFDLHWRNJS-UHFFFAOYSA-N	-2	1	387.454	2.547	20	0		GFADML
O=C([O-])[C@@H](c1cccc(Cl)c1)N1CCN(C(=O)c2cc(F)ccc2[O-])CC1	ZINC000833173676	604708702	/nfs/dbraw/zinc/70/87/02/604708702.db2.gz	UWKPPECVFZCBPN-QGZVFWFLSA-N	-2	1	392.814	2.768	20	0		GFADML
CC(C)(C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)cc2C(=O)[O-])cc1	ZINC000833430448	604744480	/nfs/dbraw/zinc/74/44/80/604744480.db2.gz	CSSSBUUAEQNJMQ-UHFFFAOYSA-N	-2	1	394.424	2.853	20	0		GFADML
CC(C)n1ncc2cc(S(=O)(=O)[N-]c3ccc(OCC(=O)[O-])cc3)ccc21	ZINC000827207052	604767739	/nfs/dbraw/zinc/76/77/39/604767739.db2.gz	JUKYUJQXUPCPRB-UHFFFAOYSA-N	-2	1	389.433	2.881	20	0		GFADML
CN(Cc1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)cc1)C(=O)[O-]	ZINC000830840204	604769667	/nfs/dbraw/zinc/76/96/67/604769667.db2.gz	LFFUYVIEYAVTCI-UHFFFAOYSA-N	-2	1	398.824	2.949	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ncccc2Br)c1	ZINC000833297132	604798247	/nfs/dbraw/zinc/79/82/47/604798247.db2.gz	JCJWMDRMPLZYIH-UHFFFAOYSA-N	-2	1	391.630	2.997	20	0		GFADML
COc1ccc2oc([C@@H](C)[N-]S(=O)(=O)c3csnc3C(=O)[O-])c(C)c2c1	ZINC000566175876	605025467	/nfs/dbraw/zinc/02/54/67/605025467.db2.gz	GMHNJKFROWCKLH-SECBINFHSA-N	-2	1	396.446	2.944	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cccc(F)c1C(=O)[O-])c1nc(C2CCCCC2)no1	ZINC000833523324	605041212	/nfs/dbraw/zinc/04/12/12/605041212.db2.gz	MGEYUVRTIKZXMQ-JTQLQIEISA-N	-2	1	397.428	2.994	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1C(=O)[O-])c1nc(C2CC2)no1	ZINC000833472507	605172290	/nfs/dbraw/zinc/17/22/90/605172290.db2.gz	YZDLNYSGSCVROX-CYBMUJFWSA-N	-2	1	399.856	2.974	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)c([O-])c1	ZINC000834259300	605643196	/nfs/dbraw/zinc/64/31/96/605643196.db2.gz	YHHJYTVUOSNOSC-INIZCTEOSA-N	-2	1	383.404	2.576	20	0		GFADML
Cc1ccc(C=CS(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)cc1	ZINC000822233172	606622061	/nfs/dbraw/zinc/62/20/61/606622061.db2.gz	IZMYZKFJYGKJKW-MDZDMXLPSA-N	-2	1	387.469	2.539	20	0		GFADML
O=C(N[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1)c1ccc(Cl)cc1[O-]	ZINC000055664943	654779810	/nfs/dbraw/zinc/77/98/10/654779810.db2.gz	BUOLEBASRQZBJE-UHFFFAOYSA-N	-2	1	394.758	2.688	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)cc1Cl	ZINC000057115631	654800673	/nfs/dbraw/zinc/80/06/73/654800673.db2.gz	VFDRKKLZHLHMRC-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cc3c(cc2Cl)OCCO3)sc1C(=O)[O-]	ZINC000107821122	655125187	/nfs/dbraw/zinc/12/51/87/655125187.db2.gz	LWBKABPZLAZQJK-UHFFFAOYSA-N	-2	1	389.838	2.980	20	0		GFADML
Cc1ccc(-n2[n-]c(C(=O)Nc3nc(Br)ccc3[O-])cc2=O)cc1	ZINC000188338054	655379491	/nfs/dbraw/zinc/37/94/91/655379491.db2.gz	XKYUIWITXCSSRW-UHFFFAOYSA-N	-2	1	389.209	2.589	20	0		GFADML
CNC(=O)c1cccc([N-]S(=O)(=O)c2cc(C)c(Cl)c(C(=O)[O-])c2)c1	ZINC000759093551	655947318	/nfs/dbraw/zinc/94/73/18/655947318.db2.gz	DFPCHLVCVFTFNJ-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
C[C@@H]1CCCC[C@H]1OCC[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F	ZINC000761262540	656005865	/nfs/dbraw/zinc/00/58/65/656005865.db2.gz	FSFCUSPZUYITHJ-ZWNOBZJWSA-N	-2	1	377.409	2.537	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])cc(C(=O)[O-])c1F	ZINC000763281608	656078260	/nfs/dbraw/zinc/07/82/60/656078260.db2.gz	QISBDAKHBVZLOR-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)OCCO3)cc(Cl)c1F	ZINC000767738482	656218075	/nfs/dbraw/zinc/21/80/75/656218075.db2.gz	XOXWLSANCGMWLL-UHFFFAOYSA-N	-2	1	387.772	2.749	20	0		GFADML
Cc1cccc([C@H]([N-]S(=O)(=O)c2c(Cl)ccnc2Cl)C(=O)[O-])c1	ZINC000776500952	656748637	/nfs/dbraw/zinc/74/86/37/656748637.db2.gz	RMESWAWADRUZNS-NSHDSACASA-N	-2	1	375.233	2.801	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccc(F)cc1	ZINC000776538888	656754234	/nfs/dbraw/zinc/75/42/34/656754234.db2.gz	SFEJAZXJFXGQAK-JTQLQIEISA-N	-2	1	379.196	2.632	20	0		GFADML
C[C@H](CCCCC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000776554583	656757385	/nfs/dbraw/zinc/75/73/85/656757385.db2.gz	HIEWREMIHMKHIL-MRVPVSSYSA-N	-2	1	399.694	2.809	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)[C@@H](O)c1ccccc1	ZINC000776599830	656764916	/nfs/dbraw/zinc/76/49/16/656764916.db2.gz	HKGMCZNPKBYQPV-MNOVXSKESA-N	-2	1	396.273	2.520	20	0		GFADML
Cc1cc(Cl)ccc1CN1CCC[C@H]([N-]C(=O)C(F)(F)F)[C@@H]1C(=O)[O-]	ZINC000903707177	663804655	/nfs/dbraw/zinc/80/46/55/663804655.db2.gz	SHZWTZVDDLGGJX-QWHCGFSZSA-N	-2	1	378.778	2.745	20	0		GFADML
COC(=O)c1ccc(F)c(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2Cl)c1	ZINC000920314116	664524819	/nfs/dbraw/zinc/52/48/19/664524819.db2.gz	HBNUFLGCXOTTIR-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COC(=O)c1ccc(F)c(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c1	ZINC000920310377	664524910	/nfs/dbraw/zinc/52/49/10/664524910.db2.gz	DTLXCAUGUCBUDM-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]CC[C@H](CC(=O)[O-])C(F)(F)F)c(F)cc1F	ZINC000285013254	563498802	/nfs/dbraw/zinc/49/88/02/563498802.db2.gz	HNSOVVKZKRJQEF-MRVPVSSYSA-N	-2	1	375.315	2.595	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCC(F)(F)C1	ZINC000436765899	563679319	/nfs/dbraw/zinc/67/93/19/563679319.db2.gz	CBFLYCMSCXJAIK-UHFFFAOYSA-N	-2	1	388.417	2.736	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)Nc1cccc(C(=O)[O-])c1O	ZINC000436998325	563687416	/nfs/dbraw/zinc/68/74/16/563687416.db2.gz	YPRLFPAHPWAKJH-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1Cl)c1nc(C(C)(C)C)no1	ZINC000565061349	564264582	/nfs/dbraw/zinc/26/45/82/564264582.db2.gz	CAZZKXFOJFBQHZ-QMMMGPOBSA-N	-2	1	387.845	2.758	20	0		GFADML
CNC(=O)c1ccc(S(=O)(=O)[N-]c2c(C)ccc(Cl)c2C(=O)[O-])cc1	ZINC000475744503	564317591	/nfs/dbraw/zinc/31/75/91/564317591.db2.gz	BZSZABCKBJQZOZ-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
C[C@@H](CC(=O)[O-])[N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl	ZINC000479196284	564430915	/nfs/dbraw/zinc/43/09/15/564430915.db2.gz	YNAQCBVDWKXODT-YFKPBYRVSA-N	-2	1	391.070	2.897	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2C)cc1C(N)=O	ZINC000479444373	564440639	/nfs/dbraw/zinc/44/06/39/564440639.db2.gz	XOUCXOAISJNVEH-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc([S@@](C)=O)cc1	ZINC000479473879	564441355	/nfs/dbraw/zinc/44/13/55/564441355.db2.gz	ZEVJAQXQLKTXHO-HSZRJFAPSA-N	-2	1	387.866	2.885	20	0		GFADML
C[C@@H](CCC[C@H](C)C(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000547609069	564501630	/nfs/dbraw/zinc/50/16/30/564501630.db2.gz	MPUZBGFPUAQHJS-UWVGGRQHSA-N	-2	1	378.834	2.806	20	0		GFADML
O=C([O-])[C@@H]1CCCCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000547934793	564523527	/nfs/dbraw/zinc/52/35/27/564523527.db2.gz	JBYUSZPGNXIPDL-ZJUUUORDSA-N	-2	1	380.260	2.744	20	0		GFADML
CCc1ccc([C@@H](COC)[N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)o1	ZINC000517138150	564525063	/nfs/dbraw/zinc/52/50/63/564525063.db2.gz	XQCOGGLSRSNWOB-CQSZACIVSA-N	-2	1	387.841	2.860	20	0		GFADML
O=C([O-])CC[N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl	ZINC000484589787	564592035	/nfs/dbraw/zinc/59/20/35/564592035.db2.gz	YTJDCKVLXJBUJP-UHFFFAOYSA-N	-2	1	377.043	2.509	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2c[nH]c(C(=O)[O-])c2)cc1Br	ZINC000488385037	564711451	/nfs/dbraw/zinc/71/14/51/564711451.db2.gz	IJQLHNFSNKYPPL-UHFFFAOYSA-N	-2	1	389.227	2.675	20	0		GFADML
Cc1ncsc1[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000527051646	564727907	/nfs/dbraw/zinc/72/79/07/564727907.db2.gz	AHXNLXNGEAXXQF-SSDOTTSWSA-N	-2	1	387.291	2.924	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)cc1Cl	ZINC000466290719	564936958	/nfs/dbraw/zinc/93/69/58/564936958.db2.gz	YMDUTMMDZZVZKW-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1cc(Br)cc(S(=O)(=O)[N-]c2cc(O)cc(F)c2)c1	ZINC000504293007	565037420	/nfs/dbraw/zinc/03/74/20/565037420.db2.gz	IERYQPNWHHMEGR-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2cc(C(F)(F)F)ccc2[N-]S(C)(=O)=O)o1	ZINC000536905653	565049854	/nfs/dbraw/zinc/04/98/54/565049854.db2.gz	PNKXQKUVVZMDND-UHFFFAOYSA-N	-2	1	398.384	2.779	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(C(=O)NCCCC(=O)[O-])ccc2C)c1	ZINC000262676043	597274628	/nfs/dbraw/zinc/27/46/28/597274628.db2.gz	YLODZOZGUPQGDP-UHFFFAOYSA-N	-2	1	390.461	2.699	20	0		GFADML
O=C([O-])CCCCCNC(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1[O-]	ZINC000569810754	599738131	/nfs/dbraw/zinc/73/81/31/599738131.db2.gz	QABCXTMCVLTLHH-SFHVURJKSA-N	-2	1	398.459	2.911	20	0		GFADML
C[C@@H]1Cc2ccccc2N(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736823147	599773825	/nfs/dbraw/zinc/77/38/25/599773825.db2.gz	AQTZYTLHTLJZET-CQSZACIVSA-N	-2	1	391.427	2.632	20	0		GFADML
COCCOc1ccc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])cc1C	ZINC000067660026	599851524	/nfs/dbraw/zinc/85/15/24/599851524.db2.gz	DXJNACNUOATNRY-UHFFFAOYSA-N	-2	1	383.397	2.658	20	0		GFADML
O=C([O-])CCc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)cc1	ZINC000739766936	599854230	/nfs/dbraw/zinc/85/42/30/599854230.db2.gz	OVTFMLMBQVIXHJ-UHFFFAOYSA-N	-2	1	388.445	2.779	20	0		GFADML
CCC[C@H]1CCCC[C@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736973907	599869480	/nfs/dbraw/zinc/86/94/80/599869480.db2.gz	KWGHXACFMISNOT-KBXCAEBGSA-N	-2	1	385.464	2.881	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(CSCC(=O)[O-])c2)cc1F	ZINC000738069931	599927454	/nfs/dbraw/zinc/92/74/54/599927454.db2.gz	RUFXBUVQQUSVFU-UHFFFAOYSA-N	-2	1	385.438	2.953	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1cc(S(=O)(=O)[N-]c2cccc(C)c2)ccc1C	ZINC000262387728	600024810	/nfs/dbraw/zinc/02/48/10/600024810.db2.gz	IAEANWIOZTVQFG-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1cccc(OC[C@H]2CCCO2)c1	ZINC000740144336	600096887	/nfs/dbraw/zinc/09/68/87/600096887.db2.gz	MMUZOYCAROJSTD-OAHLLOKOSA-N	-2	1	395.408	2.883	20	0		GFADML
COC(=O)Nc1cc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])ccc1F	ZINC000737641983	600101091	/nfs/dbraw/zinc/10/10/91/600101091.db2.gz	KGAWWGCXLWETRK-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
CC[C@]([N-]S(=O)(=O)c1c(F)cc(OC)cc1F)(C(=O)[O-])c1ccccc1	ZINC000736920769	600136735	/nfs/dbraw/zinc/13/67/35/600136735.db2.gz	RYNHXTFCGCHPPE-QGZVFWFLSA-N	-2	1	385.388	2.642	20	0		GFADML
CC(C)c1ccc([N-]S(=O)(=O)c2ccc3c(c2)C(=O)NCC3)c(C(=O)[O-])c1	ZINC000736514874	600211157	/nfs/dbraw/zinc/21/11/57/600211157.db2.gz	DKIYCDNGFOODBL-UHFFFAOYSA-N	-2	1	388.445	2.595	20	0		GFADML
Cn1cnc(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2ccc(C(C)(C)C)cc2)c1Cl	ZINC000739048897	600452398	/nfs/dbraw/zinc/45/23/98/600452398.db2.gz	RDLHONVNJOGTRA-ZDUSSCGKSA-N	-2	1	399.900	2.865	20	0		GFADML
CC(C)N(CCC(=O)[O-])C(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1	ZINC000262417354	600596242	/nfs/dbraw/zinc/59/62/42/600596242.db2.gz	MKTSDIGGVDLWHK-UHFFFAOYSA-N	-2	1	390.461	2.813	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1OCC	ZINC000673982812	600625866	/nfs/dbraw/zinc/62/58/66/600625866.db2.gz	PQRIQUJJAHDYSP-UHFFFAOYSA-N	-2	1	379.434	2.912	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3cc(C(=O)[O-])ccc3C)cc21	ZINC000265437306	600634086	/nfs/dbraw/zinc/63/40/86/600634086.db2.gz	IXOGACRMYGNKNJ-UHFFFAOYSA-N	-2	1	388.445	2.793	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2ccc(-n3cnc4ccccc43)cc2)cc1C(=O)[O-]	ZINC000503434057	600809472	/nfs/dbraw/zinc/80/94/72/600809472.db2.gz	YQNNYQKHMBXYPY-UHFFFAOYSA-N	-2	1	396.428	2.863	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NC(C)C)c(C)c2)cc1C(=O)[O-]	ZINC000595370311	600816420	/nfs/dbraw/zinc/81/64/20/600816420.db2.gz	HDVWZDLCEQXYSU-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3ccc(C(=O)[O-])c(C)c3)cn2)n1	ZINC000506705220	600888758	/nfs/dbraw/zinc/88/87/58/600888758.db2.gz	APDQVFLZNIXTNY-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(C(=O)NC3CC3)c2)c1	ZINC000740076459	600888954	/nfs/dbraw/zinc/88/89/54/600888954.db2.gz	YYCJYUOFYQLGQG-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3cc(Cl)cc(C(=O)[O-])c3)c2)n[nH]1	ZINC000738831962	600891478	/nfs/dbraw/zinc/89/14/78/600891478.db2.gz	NJFIQOPBRZKTIH-UHFFFAOYSA-N	-2	1	392.824	2.933	20	0		GFADML
Cc1cc(F)cc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(/C=C\C(=O)[O-])cc1	ZINC000832887540	601328002	/nfs/dbraw/zinc/32/80/02/601328002.db2.gz	KCKVFDRJDREKOU-DAXSKMNVSA-N	-3	1	379.365	2.731	20	0		GFADML
CC1=C(C(=O)[O-])[C@@H](c2cc(F)c([O-])c(F)c2)NC(=O)N1CCCCCC(=O)[O-]	ZINC000828134521	601396535	/nfs/dbraw/zinc/39/65/35/601396535.db2.gz	HNUKALYJRRKCQM-OAHLLOKOSA-N	-3	1	398.362	2.740	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(C(=O)NC3CC3)cc2)ccc1Cl	ZINC000013460394	601826418	/nfs/dbraw/zinc/82/64/18/601826418.db2.gz	DHBBPYIMQXDSST-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(F)c(C(=O)[O-])c2)ccc1Cl	ZINC000757471754	601827683	/nfs/dbraw/zinc/82/76/83/601827683.db2.gz	FUMJYBKQBQSJRC-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1nc(-c2ccc([N-]S(=O)(=O)c3ccc(Cl)c(C(=O)[O-])c3)cc2)n[nH]1	ZINC000747696690	601828883	/nfs/dbraw/zinc/82/88/83/601828883.db2.gz	GVIYAKDVODDGPS-UHFFFAOYSA-N	-2	1	392.824	2.933	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)ccc1Cl	ZINC000831348320	601830479	/nfs/dbraw/zinc/83/04/79/601830479.db2.gz	ALSBWPLOWBHAOY-UHFFFAOYSA-N	-2	1	398.824	2.695	20	0		GFADML
Cc1cc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)ccc1C(=O)[O-]	ZINC000728266443	601840156	/nfs/dbraw/zinc/84/01/56/601840156.db2.gz	UHGFHVDQFQRGAR-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
COc1ccc(-c2nc(SCc3nccs3)[n-]c(=O)c2-c2nnn[n-]2)cc1	ZINC000826181761	607530728	/nfs/dbraw/zinc/53/07/28/607530728.db2.gz	MVTNFUFJGGUJBY-UHFFFAOYSA-N	-2	1	399.461	2.787	20	0		GFADML
CCc1ccc(-c2noc([C@H](C)[N-]S(=O)(=O)c3ccc(C(=O)[O-])o3)n2)cc1	ZINC000830228941	602173154	/nfs/dbraw/zinc/17/31/54/602173154.db2.gz	IVODMNZOLCEOCP-JTQLQIEISA-N	-2	1	391.405	2.630	20	0		GFADML
O=C([O-])N[C@H](Cc1ccccc1)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1	ZINC000740690148	602566089	/nfs/dbraw/zinc/56/60/89/602566089.db2.gz	FRLXLCADDLJFED-LJQANCHMSA-N	-2	1	396.443	2.692	20	0		GFADML
CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2CN(C)C(=O)[O-])cc1	ZINC000739209701	602653785	/nfs/dbraw/zinc/65/37/85/602653785.db2.gz	QSBAFBANXKUAGG-UHFFFAOYSA-N	-2	1	391.449	2.946	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)c([O-])c1	ZINC000740697914	602853293	/nfs/dbraw/zinc/85/32/93/602853293.db2.gz	LMCSMCGDMVLAKB-UHFFFAOYSA-N	-2	1	393.399	2.622	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c([O-])c1	ZINC000740699751	602868274	/nfs/dbraw/zinc/86/82/74/602868274.db2.gz	YAMBLLRYWSLRGS-AWEZNQCLSA-N	-2	1	389.795	2.671	20	0		GFADML
O=C([O-])N1CCc2nc([N-]C(=O)c3noc(-c4cccc(F)c4)n3)sc2C1	ZINC000831810231	603773972	/nfs/dbraw/zinc/77/39/72/603773972.db2.gz	KJEWRSJKEHEEQM-UHFFFAOYSA-N	-2	1	389.368	2.621	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc3c(cc2NC(=O)[O-])OCO3)cc1C	ZINC000829510444	603888336	/nfs/dbraw/zinc/88/83/36/603888336.db2.gz	JFYKAAYUGHLDTL-UHFFFAOYSA-N	-2	1	380.378	2.623	20	0		GFADML
CCCC[C@H](CNC(=O)[O-])NC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1	ZINC000826789698	603889670	/nfs/dbraw/zinc/88/96/70/603889670.db2.gz	XOEDSBWLJMBUEJ-MRXNPFEDSA-N	-2	1	391.468	2.823	20	0		GFADML
CC(C)(C)OC(=O)NC[C@H]1CCC[C@H]1NC(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000823816903	603910397	/nfs/dbraw/zinc/91/03/97/603910397.db2.gz	GSHLRQIRLLIPAR-BXUZGUMPSA-N	-2	1	393.440	2.905	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])c1C	ZINC000828800188	604013849	/nfs/dbraw/zinc/01/38/49/604013849.db2.gz	VSDUYBSZIDAZKT-UHFFFAOYSA-N	-2	1	390.417	2.623	20	0		GFADML
CC(C)CC[C@@H]1CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000826845775	604342456	/nfs/dbraw/zinc/34/24/56/604342456.db2.gz	ZJYBJZWUESFSQU-KRWDZBQOSA-N	-2	1	385.464	2.834	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1nc(CCC(=O)[O-])cs1	ZINC000829545651	604345597	/nfs/dbraw/zinc/34/55/97/604345597.db2.gz	DNWKSUVBHMURGI-UHFFFAOYSA-N	-2	1	397.478	2.564	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ccc(F)cc1C(=O)[O-])c1nc(C2CCCCC2)no1	ZINC000833522607	604689241	/nfs/dbraw/zinc/68/92/41/604689241.db2.gz	CQRJERSRYMQWOL-JTQLQIEISA-N	-2	1	397.428	2.994	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CC[C@](O)(Cc3cccc(Cl)c3)C2)c([O-])c1	ZINC000834259107	605399858	/nfs/dbraw/zinc/39/98/58/605399858.db2.gz	WDPFKKFWGOCAIK-IBGZPJMESA-N	-2	1	390.823	2.955	20	0		GFADML
O=C([O-])[C@H](CSCc1cccc2ccccc21)[N-]S(=O)(=O)C(F)F	ZINC000817419646	660194938	/nfs/dbraw/zinc/19/49/38/660194938.db2.gz	FQOUCEXZXWARTH-ZDUSSCGKSA-N	-2	1	375.418	2.668	20	0		GFADML
N#Cc1ccc([N-]S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)cc1	ZINC000013345742	654504632	/nfs/dbraw/zinc/50/46/32/654504632.db2.gz	CSAKNERTJZXJBG-UHFFFAOYSA-N	-2	1	381.207	2.820	20	0		GFADML
C[C@@]1(C(=O)[O-])CCCC[C@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000135572868	655021095	/nfs/dbraw/zinc/02/10/95/655021095.db2.gz	XGVXLWSJTXNLEG-BXKDBHETSA-N	-2	1	382.301	2.822	20	0		GFADML
CC(C)(C[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)C(=O)[O-]	ZINC000275177316	655221068	/nfs/dbraw/zinc/22/10/68/655221068.db2.gz	CWULMVMXBSZPEF-UHFFFAOYSA-N	-2	1	388.642	2.631	20	0		GFADML
CN(C)C(=O)Sc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)cc1	ZINC000728508526	655556070	/nfs/dbraw/zinc/55/60/70/655556070.db2.gz	VWTGDWHKNUXVKC-UHFFFAOYSA-N	-2	1	380.447	2.959	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(F)c2)c1Cl	ZINC000754757795	655872514	/nfs/dbraw/zinc/87/25/14/655872514.db2.gz	CRDJRDYHZLDKAT-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)cc(C(=O)[O-])c1Cl	ZINC000759114117	655947978	/nfs/dbraw/zinc/94/79/78/655947978.db2.gz	LXJZBULQTWTBFM-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3oc(=O)[nH]c3c2)cc(Cl)c1F	ZINC000767740665	656217927	/nfs/dbraw/zinc/21/79/27/656217927.db2.gz	WNUXWXYBXBNUMI-UHFFFAOYSA-N	-2	1	386.744	2.825	20	0		GFADML
CN(C)c1ccc([N-]S(=O)(=O)c2cnc(Cl)c(Cl)c2)c(C(=O)[O-])c1	ZINC000776530802	656752378	/nfs/dbraw/zinc/75/23/78/656752378.db2.gz	FOIVCOVXCARQIK-UHFFFAOYSA-N	-2	1	390.248	2.953	20	0		GFADML
C[C@H]1CC(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)C[C@H](C)O1	ZINC000802722537	659495848	/nfs/dbraw/zinc/49/58/48/659495848.db2.gz	BESZIMXWIMFWDV-UWVGGRQHSA-N	-2	1	377.409	2.535	20	0		GFADML
COc1cc(C(=O)N2CC[C@H](c3ncc(C(=O)[O-])s3)C2)cc(Cl)c1[O-]	ZINC000911040507	664234108	/nfs/dbraw/zinc/23/41/08/664234108.db2.gz	QYPNDCLKXJSMRC-QMMMGPOBSA-N	-2	1	382.825	2.839	20	0		GFADML
Cc1c(Cl)ccc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2c(c1)C(=O)OC2	ZINC000919728781	664517338	/nfs/dbraw/zinc/51/73/38/664517338.db2.gz	HTLYTQUXULJMNP-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2cccc(OC(F)(F)F)c2)cc1O	ZINC000148684379	551398338	/nfs/dbraw/zinc/39/83/38/551398338.db2.gz	KLKVWNJFYNJIHV-UHFFFAOYSA-N	-2	1	377.296	2.790	20	0		GFADML
Cc1cc(F)c(Br)cc1[N-]S(=O)(=O)c1c[nH]c(C(=O)[O-])c1	ZINC000190383714	552494284	/nfs/dbraw/zinc/49/42/84/552494284.db2.gz	BOGADHUDIQKGFM-UHFFFAOYSA-N	-2	1	377.191	2.724	20	0		GFADML
CCC[C@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)C(=O)[O-]	ZINC000262464913	553171397	/nfs/dbraw/zinc/17/13/97/553171397.db2.gz	STAQIXZPFOWSDH-VIFPVBQESA-N	-2	1	388.642	2.773	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cc3c(cc2F)CCC(=O)N3)sc1C(=O)[O-]	ZINC000326944628	563456401	/nfs/dbraw/zinc/45/64/01/563456401.db2.gz	YTLJEPIACSSQFZ-UHFFFAOYSA-N	-2	1	384.410	2.579	20	0		GFADML
CCc1ccc([C@H](COC)[N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])o1	ZINC000570959548	564529689	/nfs/dbraw/zinc/52/96/89/564529689.db2.gz	HSKABPXDCALQIV-ZDUSSCGKSA-N	-2	1	387.841	2.860	20	0		GFADML
C[C@@]1(C(=O)[O-])CCC[C@H]1[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000548216560	564537515	/nfs/dbraw/zinc/53/75/15/564537515.db2.gz	HNVMEXHJZIXJHX-DGCLKSJQSA-N	-2	1	398.225	2.649	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)cc1Cl	ZINC000484486615	564589312	/nfs/dbraw/zinc/58/93/12/564589312.db2.gz	CCWTXKVMHGSIMT-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1Cl	ZINC000484535943	564590065	/nfs/dbraw/zinc/59/00/65/564590065.db2.gz	VUXBYTLPSRVSDN-UHFFFAOYSA-N	-2	1	378.793	2.681	20	0		GFADML
CN(C)C(=O)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000520037596	564596365	/nfs/dbraw/zinc/59/63/65/564596365.db2.gz	LNXISKXGYJJTDA-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2C)cc1Cl	ZINC000485229944	564610962	/nfs/dbraw/zinc/61/09/62/564610962.db2.gz	LKXVPHIMWXVJNS-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(C)cc2C(=O)[O-])c1	ZINC000525522564	564702479	/nfs/dbraw/zinc/70/24/79/564702479.db2.gz	PAMLGXATLWLJPF-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)c(F)c1	ZINC000489696454	564749450	/nfs/dbraw/zinc/74/94/50/564749450.db2.gz	NYEZARCNNASGNF-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(F)c1	ZINC000489733319	564751101	/nfs/dbraw/zinc/75/11/01/564751101.db2.gz	ZWENTBHYAWJHLQ-UHFFFAOYSA-N	-3	1	385.394	2.745	20	0		GFADML
Cc1c(C[S@](C)=O)cccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(F)c1	ZINC000489738737	564751817	/nfs/dbraw/zinc/75/18/17/564751817.db2.gz	OAAKMIZYOCCWOJ-DEOSSOPVSA-N	-2	1	385.438	2.512	20	0		GFADML
O=C([O-])c1cc(F)cc([N-]S(=O)(=O)c2cnccc2C(F)(F)F)c1F	ZINC000582215929	564836129	/nfs/dbraw/zinc/83/61/29/564836129.db2.gz	HIIXTNATPGPNGM-UHFFFAOYSA-N	-2	1	382.266	2.878	20	0		GFADML
O=C([O-])CC[C@H](C[N-]S(=O)(=O)c1cccc(Cl)c1F)C(F)(F)F	ZINC000663294413	565408183	/nfs/dbraw/zinc/40/81/83/565408183.db2.gz	QLKWUPBKCLAHAL-SSDOTTSWSA-N	-2	1	377.743	2.801	20	0		GFADML
CC1([C@H]([N-]S(=O)(=O)c2ncccc2C(F)(F)F)C(=O)[O-])CCCCC1	ZINC000650418181	565819294	/nfs/dbraw/zinc/81/92/94/565819294.db2.gz	CRRNCWXXPWGLTF-LLVKDONJSA-N	-2	1	380.388	2.802	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H]2CCCC[C@@H]2CCC(=O)[O-])c(F)c1	ZINC000654779534	566023207	/nfs/dbraw/zinc/02/32/07/566023207.db2.gz	QADHOSHGYZMIJP-YGRLFVJLSA-N	-2	1	377.409	2.675	20	0		GFADML
CO[C@H](C[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-])C1CC1	ZINC000656168141	566108812	/nfs/dbraw/zinc/10/88/12/566108812.db2.gz	DEQSKZMTYAZVJH-JGVFFNPUSA-N	-2	1	388.294	2.602	20	0		GFADML
O=C([O-])CCc1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	ZINC000739765292	599853807	/nfs/dbraw/zinc/85/38/07/599853807.db2.gz	BLPXWURXBUUYOH-UHFFFAOYSA-N	-2	1	377.418	2.666	20	0		GFADML
CCN(CC)C(=O)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1	ZINC000268609028	599904798	/nfs/dbraw/zinc/90/47/98/599904798.db2.gz	KKNSWDHLDQWKAO-UHFFFAOYSA-N	-2	1	390.461	2.976	20	0		GFADML
Cc1cc(NC(=O)Cc2c(C)nc(-c3cccnc3)[n-]c2=O)ccc1C(=O)[O-]	ZINC000534877664	599949775	/nfs/dbraw/zinc/94/97/75/599949775.db2.gz	SJLQTSNNHVPJPB-UHFFFAOYSA-N	-2	1	378.388	2.740	20	0		GFADML
CCCN(CC(=O)[O-])C(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C)cc2)c1	ZINC000262418222	600023271	/nfs/dbraw/zinc/02/32/71/600023271.db2.gz	ZUBYCPJIMVRDGY-UHFFFAOYSA-N	-2	1	390.461	2.733	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1Cl	ZINC000736159835	600094138	/nfs/dbraw/zinc/09/41/38/600094138.db2.gz	MZGIFNPHPVRROV-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)c1	ZINC000737697110	600100775	/nfs/dbraw/zinc/10/07/75/600100775.db2.gz	OIGXQCWAMKPNRU-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
O=C([O-])[C@H]1C[C@H]1C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1	ZINC000739552640	600102832	/nfs/dbraw/zinc/10/28/32/600102832.db2.gz	JHMMTRLKBVMQRO-CABCVRRESA-N	-2	1	394.836	2.800	20	0		GFADML
COC(=O)N(C)Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1	ZINC000737630820	600300813	/nfs/dbraw/zinc/30/08/13/600300813.db2.gz	IUZZPJUENBFOQV-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCC4(CCCC4)CC3)cc2)[n-]1	ZINC000739874585	600417385	/nfs/dbraw/zinc/41/73/85/600417385.db2.gz	RJWURRPVPIGQLW-UHFFFAOYSA-N	-2	1	383.448	2.589	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)ccc1OC	ZINC000610057586	600543262	/nfs/dbraw/zinc/54/32/62/600543262.db2.gz	MSDNYKWCAQNVMG-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
CC[C@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000267213987	600627616	/nfs/dbraw/zinc/62/76/16/600627616.db2.gz	SQDDSPVBRKXTMF-ZDUSSCGKSA-N	-2	1	390.461	2.643	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)c1C	ZINC000737711976	600636587	/nfs/dbraw/zinc/63/65/87/600636587.db2.gz	CVYFXLUTFKGNGN-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)c(C)c1	ZINC000737701865	600637889	/nfs/dbraw/zinc/63/78/89/600637889.db2.gz	JBOKVNMYHMTOFV-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)cc1C(=O)[O-]	ZINC000831434924	600688449	/nfs/dbraw/zinc/68/84/49/600688449.db2.gz	KZMHKSBRVJDPEK-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])s1)c1nc(-c2cccc(F)c2)no1	ZINC000827755934	600800624	/nfs/dbraw/zinc/80/06/24/600800624.db2.gz	VGMQNZXAANTKHQ-QMMMGPOBSA-N	-2	1	397.409	2.675	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N3CCCC3)cc2)cc1C(=O)[O-]	ZINC000298147193	600809093	/nfs/dbraw/zinc/80/90/93/600809093.db2.gz	XBGOSIGDRXNRMB-UHFFFAOYSA-N	-2	1	388.445	2.730	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)Nc1ccc(C(C)(C)C(=O)[O-])cc1	ZINC000738872645	600880782	/nfs/dbraw/zinc/88/07/82/600880782.db2.gz	KAXAASJKZMNQNT-UHFFFAOYSA-N	-2	1	382.420	2.595	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)c1	ZINC000506719448	600888806	/nfs/dbraw/zinc/88/88/06/600888806.db2.gz	NQHSWERBCWSVMV-UHFFFAOYSA-N	-2	1	376.434	2.552	20	0		GFADML
O=C([O-])c1sccc1S(=O)(=O)[N-]c1ccc(N2CCSCC2)cc1	ZINC000740289302	600897742	/nfs/dbraw/zinc/89/77/42/600897742.db2.gz	IPUPKTWKQJMJIZ-UHFFFAOYSA-N	-2	1	384.504	2.800	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)NCCCCC3CCCC3)cc2)[n-]1	ZINC000833265998	600935531	/nfs/dbraw/zinc/93/55/31/600935531.db2.gz	IQQXRGTWKLINNC-UHFFFAOYSA-N	-2	1	385.464	2.883	20	0		GFADML
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000828161774	601140015	/nfs/dbraw/zinc/14/00/15/601140015.db2.gz	PKMWYAGFJRSNSU-DYVFJYSZSA-N	-2	1	385.464	2.737	20	0		GFADML
O=C([O-])CCCOc1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000833228003	601225009	/nfs/dbraw/zinc/22/50/09/601225009.db2.gz	XCMZTJPLORSWLX-UHFFFAOYSA-N	-3	1	397.380	2.568	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)cc2)c1C	ZINC000013079310	601318759	/nfs/dbraw/zinc/31/87/59/601318759.db2.gz	USUPLCCKXHIOEE-UHFFFAOYSA-N	-2	1	388.445	2.929	20	0		GFADML
Cc1ccc(C(=O)N(C)C)cc1[N-]S(=O)(=O)c1ccc(/C=C\C(=O)[O-])cc1	ZINC000832911837	601324044	/nfs/dbraw/zinc/32/40/44/601324044.db2.gz	QMINOFDCOXPWLS-XFFZJAGNSA-N	-2	1	388.445	2.595	20	0		GFADML
COC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(C=CC(=O)[O-])cc2)cc1	ZINC000831210100	601324903	/nfs/dbraw/zinc/32/49/03/601324903.db2.gz	LNDNGEHVZMJIKC-WCIBSUBMSA-N	-2	1	376.390	2.764	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1	ZINC000831160088	601330569	/nfs/dbraw/zinc/33/05/69/601330569.db2.gz	NGVIUPRSGZLPBB-SDQBBNPISA-N	-2	1	389.429	2.691	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(OCc3ccccn3)c(F)c2)c[nH]1	ZINC000476396759	601334796	/nfs/dbraw/zinc/33/47/96/601334796.db2.gz	JTFGYMSBRFNDOP-UHFFFAOYSA-N	-2	1	391.380	2.627	20	0		GFADML
CC(=O)N(C)c1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000745978061	601829954	/nfs/dbraw/zinc/82/99/54/601829954.db2.gz	CKJMNHZZRWUWSS-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
CCOCCOCc1cccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])c1	ZINC000830017885	601857949	/nfs/dbraw/zinc/85/79/49/601857949.db2.gz	YSLKBSOSGISGCQ-UHFFFAOYSA-N	-2	1	397.424	2.878	20	0		GFADML
CSc1nc(C)c(CCC(=O)Oc2ccc(SCC(=O)[O-])cc2)c(=O)[n-]1	ZINC000832795170	601878689	/nfs/dbraw/zinc/87/86/89/601878689.db2.gz	WVNZASKFSGMQIJ-UHFFFAOYSA-N	-2	1	394.474	2.927	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)ccc1Cl	ZINC000757475540	601987784	/nfs/dbraw/zinc/98/77/84/601987784.db2.gz	AGFQMRDAPYMAIQ-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
CC1(C)Cc2cc([N-]S(=O)(=O)c3ccc(Cl)nc3C(=O)[O-])ccc2O1	ZINC000828078416	602309449	/nfs/dbraw/zinc/30/94/49/602309449.db2.gz	MTMYAPMIVJZUSQ-UHFFFAOYSA-N	-2	1	382.825	2.948	20	0		GFADML
C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3ccccc3CN(C)C(=O)[O-])ccc2O1	ZINC000739191137	602653958	/nfs/dbraw/zinc/65/39/58/602653958.db2.gz	RCJFPNIVBBXPDJ-GFCCVEGCSA-N	-2	1	376.434	2.921	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)OCCN(C)C(=O)[O-])cc1	ZINC000738321382	602660706	/nfs/dbraw/zinc/66/07/06/602660706.db2.gz	DOLFQIAJBASMKH-UHFFFAOYSA-N	-2	1	392.433	2.562	20	0		GFADML
C[C@@H]1CN(c2ccc(NC(=O)c3ccc(NC(=O)[O-])cc3[O-])cn2)C[C@@H](C)O1	ZINC000739192254	602850863	/nfs/dbraw/zinc/85/08/63/602850863.db2.gz	IPSSQENDVGZSET-VXGBXAGGSA-N	-2	1	386.408	2.743	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC[C@H]1NC(=O)OC(C)(C)C	ZINC000739167579	602869077	/nfs/dbraw/zinc/86/90/77/602869077.db2.gz	MQKDLGSUGOVBNZ-BXUZGUMPSA-N	-2	1	393.440	2.857	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])CC[C@H]1NC(=O)[O-]	ZINC000739164388	602869388	/nfs/dbraw/zinc/86/93/88/602869388.db2.gz	CPQGHWYSRYGEJK-BXUZGUMPSA-N	-2	1	393.440	2.857	20	0		GFADML
CC(C)(CC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1)NC(=O)[O-]	ZINC000738739777	603022175	/nfs/dbraw/zinc/02/21/75/603022175.db2.gz	YATXBKDAUPHVQX-UHFFFAOYSA-N	-2	1	391.449	2.862	20	0		GFADML
CCc1cc2c(COC(=O)[C@@H]3CCC[C@@H]3NC(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000739542638	603127763	/nfs/dbraw/zinc/12/77/63/603127763.db2.gz	LGTZGMMJLYJMND-OCCSQVGLSA-N	-2	1	375.377	2.541	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)Nc1ccc([C@@H](C)NC(=O)[O-])cc1	ZINC000830784909	603194485	/nfs/dbraw/zinc/19/44/85/603194485.db2.gz	FSJBWJVCVMZCOU-SNVBAGLBSA-N	-2	1	383.408	2.562	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NCC1(NC(=O)[O-])CCCCCC1	ZINC000830704110	603441290	/nfs/dbraw/zinc/44/12/90/603441290.db2.gz	LHVKWZLVYUTMPY-UHFFFAOYSA-N	-2	1	378.473	2.879	20	0		GFADML
C[C@H]1Cc2cc(S(=O)(=O)[N-]c3cc4c(cc3NC(=O)[O-])OCO4)ccc2O1	ZINC000826094105	603887410	/nfs/dbraw/zinc/88/74/10/603887410.db2.gz	RXTZVUQZFVUDQM-VIFPVBQESA-N	-2	1	392.389	2.629	20	0		GFADML
CSc1nc(C)c(CCC(=O)O[C@@H](C)[C@@H]2CCCCN2C(=O)[O-])c(=O)[n-]1	ZINC000829777714	604120117	/nfs/dbraw/zinc/12/01/17/604120117.db2.gz	LEMKXNHXFGBYSW-AAEUAGOBSA-N	-2	1	383.470	2.609	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)cc1C(=O)[O-]	ZINC000767736306	604632011	/nfs/dbraw/zinc/63/20/11/604632011.db2.gz	IOABWKVBSXLHDB-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CC(C)(NC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-])C(=O)[O-]	ZINC000833461076	604704959	/nfs/dbraw/zinc/70/49/59/604704959.db2.gz	MRWQINOIXPLMBS-UHFFFAOYSA-N	-2	1	378.331	2.516	20	0		GFADML
Cc1ccc(-c2nc(C(=O)[N-]c3nnc(CCCC(=O)[O-])s3)cs2)n1C	ZINC000833746525	604758377	/nfs/dbraw/zinc/75/83/77/604758377.db2.gz	IZDGPYUVSDZLMO-UHFFFAOYSA-N	-2	1	391.478	2.968	20	0		GFADML
COCc1cccc(S(=O)(=O)[N-]c2ccc(OCC(=O)[O-])c(Cl)c2)c1	ZINC000831822058	604806568	/nfs/dbraw/zinc/80/65/68/604806568.db2.gz	OHSPEEQJNLETBU-UHFFFAOYSA-N	-2	1	385.825	2.751	20	0		GFADML
O=C([O-])COc1ccc([N-]S(=O)(=O)c2ccc3c(c2)COC3)cc1Cl	ZINC000833259702	604807415	/nfs/dbraw/zinc/80/74/15/604807415.db2.gz	RTAPRINTKINTLD-UHFFFAOYSA-N	-2	1	383.809	2.634	20	0		GFADML
CC1(C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])c(F)c3)cc21	ZINC000833555364	605264900	/nfs/dbraw/zinc/26/49/00/605264900.db2.gz	MASXHQATBAPYDO-UHFFFAOYSA-N	-2	1	393.396	2.946	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCOC[C@H]2C[C@H](O)c2cccs2)c([O-])c1	ZINC000834258547	605656020	/nfs/dbraw/zinc/65/60/20/605656020.db2.gz	QMZWRSWZISUEAD-DOMZBBRYSA-N	-2	1	392.433	2.508	20	0		GFADML
O=C([O-])N(CC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1)C1CC1	ZINC000834003146	605980865	/nfs/dbraw/zinc/98/08/65/605980865.db2.gz	BNNAXSYGSFZPDJ-UHFFFAOYSA-N	-2	1	389.433	2.568	20	0		GFADML
O=C(N[N-]S(=O)(=O)c1ccccc1C(F)(F)F)c1ccc(Cl)cc1[O-]	ZINC000055665128	654780187	/nfs/dbraw/zinc/78/01/87/654780187.db2.gz	AHXDNDXIKNUHIU-UHFFFAOYSA-N	-2	1	394.758	2.688	20	0		GFADML
O=C([O-])c1ccc(Br)c(S(=O)(=O)[N-]c2ccc3c(c2)CCO3)c1	ZINC000319910109	655381925	/nfs/dbraw/zinc/38/19/25/655381925.db2.gz	YNFVYIAMUUJENN-UHFFFAOYSA-N	-2	1	398.234	2.883	20	0		GFADML
CC[C@H](C)C(=O)[N-][N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F	ZINC000190727278	655394531	/nfs/dbraw/zinc/39/45/31/655394531.db2.gz	KXZQYYONINPLAK-LURJTMIESA-N	-2	1	387.658	2.597	20	0		GFADML
O=C([O-])[C@H](O)[C@H](CC1CCCCC1)[N-]S(=O)(=O)c1cc(Cl)ccc1F	ZINC000578017289	655471294	/nfs/dbraw/zinc/47/12/94/655471294.db2.gz	XJTRSKKBIHPJTJ-DZGCQCFKSA-N	-2	1	393.864	2.542	20	0		GFADML
COCc1ccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(Cl)c2)cc1	ZINC000766583292	656176952	/nfs/dbraw/zinc/17/69/52/656176952.db2.gz	FZRFJNCYYYKPFP-UHFFFAOYSA-N	-2	1	385.825	2.751	20	0		GFADML
O=C([O-])Cc1cccc([N-]S(=O)(=O)c2ccc3nc(Cl)cnc3c2)c1	ZINC000776453794	656743582	/nfs/dbraw/zinc/74/35/82/656743582.db2.gz	NIJAOJLOYUXDHY-UHFFFAOYSA-N	-2	1	377.809	2.711	20	0		GFADML
CC[C@H](C[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)C(=O)[O-]	ZINC000776539440	656754451	/nfs/dbraw/zinc/75/44/51/656754451.db2.gz	PAMRMKSZKQWFFB-ZCFIWIBFSA-N	-2	1	388.642	2.631	20	0		GFADML
O=C([O-])c1ccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)c(Cl)c2F)cc1	ZINC000779825413	656946066	/nfs/dbraw/zinc/94/60/66/656946066.db2.gz	RWEBBRLTBXKYBB-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
C[C@@H](CC[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)C(=O)[O-]	ZINC000788084031	657649339	/nfs/dbraw/zinc/64/93/39/657649339.db2.gz	WNWJDGCLOHABET-LURJTMIESA-N	-2	1	388.642	2.631	20	0		GFADML
Cc1cc(F)c(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1C[S@](C)=O	ZINC000793410965	658394135	/nfs/dbraw/zinc/39/41/35/658394135.db2.gz	WFHKWIZIIXJNTG-DEOSSOPVSA-N	-2	1	385.438	2.512	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-][C@@H]2Cc3ccc(Cl)cc3C2)c1	ZINC000800723669	659329136	/nfs/dbraw/zinc/32/91/36/659329136.db2.gz	SQYVVCCKEDJQSP-GFCCVEGCSA-N	-2	1	387.791	2.762	20	0		GFADML
CCC[C@@H](C(=O)OCC)S(=O)(=O)[N-]c1ccc(Br)cc1[O-]	ZINC000844654899	661432180	/nfs/dbraw/zinc/43/21/80/661432180.db2.gz	LYUVKEYBVBEPKE-LBPRGKRZSA-N	-2	1	380.260	2.628	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]CCC[C@@H]2CC2(Cl)Cl)c1	ZINC000844902435	661448672	/nfs/dbraw/zinc/44/86/72/661448672.db2.gz	QUZVGZGBTFIZMU-MRVPVSSYSA-N	-2	1	388.219	2.915	20	0		GFADML
Cc1ccc(CN2CCC[C@H]([N-]C(=O)C(F)(F)F)[C@H]2C(=O)[O-])c(Cl)c1	ZINC000852733678	661872692	/nfs/dbraw/zinc/87/26/92/661872692.db2.gz	WDCWMZKWKYEXQM-STQMWFEESA-N	-2	1	378.778	2.745	20	0		GFADML
C[C@@H]1CC[C@@H](C(=O)[O-])C[C@@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000871771914	662733231	/nfs/dbraw/zinc/73/32/31/662733231.db2.gz	TVOIBXTYDDKKRR-MRTMQBJTSA-N	-2	1	382.301	2.678	20	0		GFADML
C[C@@]1(C[N-]S(=O)(=O)c2sc(C(=O)[O-])cc2Br)CC1(F)F	ZINC000871984687	662749284	/nfs/dbraw/zinc/74/92/84/662749284.db2.gz	ZSCAEIOEFWJEEY-VIFPVBQESA-N	-2	1	390.227	2.532	20	0		GFADML
O=c1cc(CC2CC2)[n-]n1-c1ccc(S(=O)(=O)[N-]c2nccs2)cc1	ZINC000899353538	663684270	/nfs/dbraw/zinc/68/42/70/663684270.db2.gz	QAQFXZHUWAIPCT-UHFFFAOYSA-N	-2	1	376.463	2.837	20	0		GFADML
COc1cc(C(=O)N[C@@H]2CCSC3(CC(C(=O)[O-])C3)C2)cc(Cl)c1[O-]	ZINC000908175248	664089734	/nfs/dbraw/zinc/08/97/34/664089734.db2.gz	SXBDHWFFHBAMIE-VVHFOWEKSA-N	-2	1	385.869	2.913	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C(=O)[O-])c1	ZINC000392708246	677410066	/nfs/dbraw/zinc/41/00/66/677410066.db2.gz	AUNWFFINUAGCSI-UHFFFAOYSA-N	-2	1	386.769	2.756	20	0		GFADML
CCc1cc(Br)ccc1[N-]S(=O)(=O)c1cc(C(=O)[O-])n(C)c1	ZINC000316886981	563442442	/nfs/dbraw/zinc/44/24/42/563442442.db2.gz	RUBNMRNXFMWKPR-UHFFFAOYSA-N	-2	1	387.255	2.849	20	0		GFADML
C[C@@]1(F)CCN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C1	ZINC000331814645	563562622	/nfs/dbraw/zinc/56/26/22/563562622.db2.gz	GBBYBGKGKBSJRU-MRXNPFEDSA-N	-2	1	384.454	2.829	20	0		GFADML
NC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000410376176	563587985	/nfs/dbraw/zinc/58/79/85/563587985.db2.gz	SBFUSHSCPKWZHX-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
O=C([O-])c1ccc([O-])c(S(=O)(=O)Nc2cccc(OC(F)(F)F)c2)c1	ZINC000436892453	563684384	/nfs/dbraw/zinc/68/43/84/563684384.db2.gz	JJQVCUKZFBKIGC-UHFFFAOYSA-N	-2	1	377.296	2.790	20	0		GFADML
O=C([O-])c1ccc([O-])c(S(=O)(=O)Nc2ccc(F)c(Br)c2)c1	ZINC000436993728	563687479	/nfs/dbraw/zinc/68/74/79/563687479.db2.gz	GMDOAXZNHXEZAG-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
CC(=O)c1ccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])cc2)cc1Cl	ZINC000543021538	564335614	/nfs/dbraw/zinc/33/56/14/564335614.db2.gz	MRRPACGMKLUECU-UHFFFAOYSA-N	-2	1	383.809	2.807	20	0		GFADML
CSc1c(F)cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2[O-])cc1F	ZINC000543164106	564340698	/nfs/dbraw/zinc/34/06/98/564340698.db2.gz	KUGGEASOKUDZQM-UHFFFAOYSA-N	-2	1	375.374	2.891	20	0		GFADML
C[C@@H]([C@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-])C1CC1	ZINC000515872320	564489196	/nfs/dbraw/zinc/48/91/96/564489196.db2.gz	YSEDXTBYSZYBLC-INWYIAFRSA-N	-2	1	398.225	2.505	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cc(Cl)sc1Cl)Cc1ccccn1	ZINC000547879129	564515217	/nfs/dbraw/zinc/51/52/17/564515217.db2.gz	NMSDTGISWBKILC-MRVPVSSYSA-N	-2	1	395.289	2.672	20	0		GFADML
Nc1c([N-]S(=O)(=O)c2ccc(F)cc2)cc(Br)cc1C(=O)[O-]	ZINC000550111604	564615240	/nfs/dbraw/zinc/61/52/40/564615240.db2.gz	YKEXRTWMVMLDBN-UHFFFAOYSA-N	-2	1	389.202	2.669	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1csc(-c2ccccc2)n1)C(F)(F)F	ZINC000551997148	564672707	/nfs/dbraw/zinc/67/27/07/564672707.db2.gz	PYPIDLHQNUUECD-SNVBAGLBSA-N	-2	1	394.396	2.742	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(-c3csnn3)cc2)cc1F	ZINC000489751246	564751954	/nfs/dbraw/zinc/75/19/54/564751954.db2.gz	HGSAEEXMEUAYMS-UHFFFAOYSA-N	-2	1	379.394	2.843	20	0		GFADML
CSc1cccc(S(=O)(=O)[N-]c2ccc(NC(C)=O)cc2C(=O)[O-])c1	ZINC000669837616	565704706	/nfs/dbraw/zinc/70/47/06/565704706.db2.gz	XVPLTUGUBUPUEE-UHFFFAOYSA-N	-2	1	380.447	2.866	20	0		GFADML
O=C([O-])CC[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000650420704	565819981	/nfs/dbraw/zinc/81/99/81/565819981.db2.gz	KUXPOGNJABPTOZ-ZYHUDNBSSA-N	-2	1	380.388	2.802	20	0		GFADML
CCO[C@@H](CS(=O)(=O)[N-]c1cc(C(F)(F)F)ccc1C(=O)[O-])C1CC1	ZINC000629292609	565836122	/nfs/dbraw/zinc/83/61/22/565836122.db2.gz	RXRUKEHKFGMCQR-ZDUSSCGKSA-N	-2	1	381.372	2.960	20	0		GFADML
CC(C)(C)c1cc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(Cl)c2)[nH]n1	ZINC000675549962	565909495	/nfs/dbraw/zinc/90/94/95/565909495.db2.gz	YGIBAWRNVMYMOB-UHFFFAOYSA-N	-2	1	387.845	2.625	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1sccc1Br)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653494182	565968923	/nfs/dbraw/zinc/96/89/23/565968923.db2.gz	SPAKIRJFUIQBRU-XHNCKOQMSA-N	-2	1	396.328	2.924	20	0		GFADML
O=C([O-])CCC(=O)Nc1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2)c1	ZINC000680997258	566090203	/nfs/dbraw/zinc/09/02/03/566090203.db2.gz	FSGDLIAOQDYNAK-UHFFFAOYSA-N	-2	1	382.825	2.944	20	0		GFADML
CCOc1cc(-c2noc(CSCC(=O)[O-])n2)cc(Br)c1[O-]	ZINC000739486943	597108282	/nfs/dbraw/zinc/10/82/82/597108282.db2.gz	MHTYOMSJEWFIJF-UHFFFAOYSA-N	-2	1	389.227	2.921	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(C(=O)NCCCC(=O)[O-])cc2)c1	ZINC000262747854	597279254	/nfs/dbraw/zinc/27/92/54/597279254.db2.gz	LILJPVRRTWTPJE-UHFFFAOYSA-N	-2	1	390.461	2.699	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3nc([C@H]4CCCO4)[nH]c3c2)o1	ZINC000740187455	599739123	/nfs/dbraw/zinc/73/91/23/599739123.db2.gz	LLVZFKIZFAHLER-GFCCVEGCSA-N	-2	1	377.378	2.506	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(OCC(=O)[O-])cc2)cc1	ZINC000737030410	599765479	/nfs/dbraw/zinc/76/54/79/599765479.db2.gz	WBXHMBJSKMKFNY-UHFFFAOYSA-N	-2	1	393.417	2.518	20	0		GFADML
CC[C@H](Cc1ccccc1)NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736906130	599767304	/nfs/dbraw/zinc/76/73/04/599767304.db2.gz	LULCPJMXUXAVIZ-QGZVFWFLSA-N	-2	1	393.443	2.544	20	0		GFADML
C[C@@H](CNC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2)c1)C(=O)[O-]	ZINC000485928019	599779817	/nfs/dbraw/zinc/77/98/17/599779817.db2.gz	AAAJVEJAWDALBQ-NSHDSACASA-N	-2	1	396.852	2.591	20	0		GFADML
CC(=O)N1CCCc2cc(S(=O)(=O)[N-]c3cccc(F)c3C(=O)[O-])ccc21	ZINC000047202351	599851467	/nfs/dbraw/zinc/85/14/67/599851467.db2.gz	XCYXPHWWIDSGDH-UHFFFAOYSA-N	-2	1	392.408	2.624	20	0		GFADML
CCc1cc2c(COC(=O)[C@@H](CC(C)C)NC(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000737252869	599882497	/nfs/dbraw/zinc/88/24/97/599882497.db2.gz	UKWRTMJLTYQHME-CQSZACIVSA-N	-2	1	377.393	2.787	20	0		GFADML
COCCOc1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)ccc1OC	ZINC000268590921	599905874	/nfs/dbraw/zinc/90/58/74/599905874.db2.gz	HIDQYAHYFJTRAL-UHFFFAOYSA-N	-2	1	395.433	2.528	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)ccc1C(=O)NC(C)C	ZINC000519453994	599908304	/nfs/dbraw/zinc/90/83/04/599908304.db2.gz	XMXZPCXWTWZIAB-UHFFFAOYSA-N	-2	1	376.434	2.632	20	0		GFADML
O=C([O-])c1ccccc1S(=O)(=O)[N-]c1ccc(-c2nnc3n2CCCC3)cc1	ZINC000740242775	599974949	/nfs/dbraw/zinc/97/49/49/599974949.db2.gz	UAMVWMHTCBRHOR-UHFFFAOYSA-N	-2	1	398.444	2.780	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)OCc1ccc(F)cc1C(=O)[O-]	ZINC000737226169	600116649	/nfs/dbraw/zinc/11/66/49/600116649.db2.gz	AZVXNQRYYMYUCS-UHFFFAOYSA-N	-2	1	381.381	2.643	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ccccc1F)c1nc(-c2ccc(C(=O)[O-])cc2)no1	ZINC000736671808	600244906	/nfs/dbraw/zinc/24/49/06/600244906.db2.gz	YWNWHCUEMHNFLR-SNVBAGLBSA-N	-2	1	391.380	2.613	20	0		GFADML
O=C([O-])CCCc1nnc([N-]C(=O)c2csc(-c3ccccn3)n2)s1	ZINC000739711743	600539093	/nfs/dbraw/zinc/53/90/93/600539093.db2.gz	QNXSIAAMRCTHCZ-UHFFFAOYSA-N	-2	1	375.435	2.716	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(C)c3)cc21	ZINC000265473794	600634748	/nfs/dbraw/zinc/63/47/48/600634748.db2.gz	ZFHYRKBSLCSYJB-UHFFFAOYSA-N	-2	1	388.445	2.793	20	0		GFADML
COc1ccccc1-n1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2F)cn1	ZINC000484537105	600680843	/nfs/dbraw/zinc/68/08/43/600680843.db2.gz	HLOZYSXOJVKJLT-UHFFFAOYSA-N	-2	1	391.380	2.519	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(F)c(Br)c2)c(C(=O)[O-])[nH]1	ZINC000832899060	600681140	/nfs/dbraw/zinc/68/11/40/600681140.db2.gz	CCRFGRAKZDOQCP-UHFFFAOYSA-N	-2	1	377.191	2.724	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2c[nH]c(C(=O)[O-])c2)cc1NC(=O)C(C)(C)C	ZINC000264718817	600682059	/nfs/dbraw/zinc/68/20/59/600682059.db2.gz	HOLAOMQGTHDNSU-UHFFFAOYSA-N	-2	1	379.438	2.807	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2F)cc1	ZINC000438770911	600684963	/nfs/dbraw/zinc/68/49/63/600684963.db2.gz	LXEAROBDKGHFQC-UHFFFAOYSA-N	-2	1	381.381	2.687	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(C)c(F)c(C)c2)ccc1C(=O)[O-]	ZINC000831326897	600688702	/nfs/dbraw/zinc/68/87/02/600688702.db2.gz	BRHAAUJLCNFUCS-UHFFFAOYSA-N	-2	1	381.381	2.728	20	0		GFADML
CCCOc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)OC)c(C(=O)[O-])c2)cc1	ZINC000829537988	600688940	/nfs/dbraw/zinc/68/89/40/600688940.db2.gz	NSGIBOQGZVRRRW-UHFFFAOYSA-N	-2	1	393.417	2.761	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NCc2ccc(C(=O)[O-])o2)c([O-])c1	ZINC000736284372	600730198	/nfs/dbraw/zinc/73/01/98/600730198.db2.gz	VWKSAFFXZDMUII-UHFFFAOYSA-N	-2	1	376.365	2.960	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1)c1nc(C2CC2)no1	ZINC000566177664	600736984	/nfs/dbraw/zinc/73/69/84/600736984.db2.gz	RWYDHWFVAVMONF-ZDUSSCGKSA-N	-2	1	399.856	2.974	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)ccc1Cl	ZINC000044330229	600809936	/nfs/dbraw/zinc/80/99/36/600809936.db2.gz	NKGCTOILGWKROR-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c(C)c1	ZINC000048382821	600811626	/nfs/dbraw/zinc/81/16/26/600811626.db2.gz	AHAZPTVTNOLBGL-UHFFFAOYSA-N	-2	1	376.434	2.552	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)c(F)c2)cc1C(=O)[O-]	ZINC000460832882	600817036	/nfs/dbraw/zinc/81/70/36/600817036.db2.gz	ZMQKEJWGVKUGBD-UHFFFAOYSA-N	-2	1	382.413	2.985	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)c(C)c1	ZINC000484957044	600898859	/nfs/dbraw/zinc/89/88/59/600898859.db2.gz	YPEHTISMUBDANV-UHFFFAOYSA-N	-2	1	391.445	2.945	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)N1C[C@@H](CC(=O)[O-])c2ccccc21	ZINC000737226415	600908032	/nfs/dbraw/zinc/90/80/32/600908032.db2.gz	LNRHIIFPRSXUEJ-CYBMUJFWSA-N	-2	1	388.445	2.667	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2cc(F)c(C(=O)[O-])c(F)c2)c1	ZINC000740075709	601118702	/nfs/dbraw/zinc/11/87/02/601118702.db2.gz	NOJFSCXVBNDEQG-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
CCC1CCC(NC(=O)CCc2c(C)nc(SC)[n-]c2=O)(C(=O)[O-])CC1	ZINC000829086527	601275568	/nfs/dbraw/zinc/27/55/68/601275568.db2.gz	OGVLBAWMVQHHIH-UHFFFAOYSA-N	-2	1	381.498	2.685	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1Cl	ZINC000014097685	601319893	/nfs/dbraw/zinc/31/98/93/601319893.db2.gz	CEEHKYPLPRROQV-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(C(=O)N3CCCC3)cc2)ccc1F	ZINC000738678332	601320527	/nfs/dbraw/zinc/32/05/27/601320527.db2.gz	HRQCWKKTQOTUIB-UHFFFAOYSA-N	-2	1	392.408	2.561	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cccc(-n3cc[nH]c3=O)c2)c1C	ZINC000832866688	601326713	/nfs/dbraw/zinc/32/67/13/601326713.db2.gz	TUAKUEUVLNLJBM-UHFFFAOYSA-N	-2	1	387.417	2.694	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(F)cc(F)cc1F)c1ccc(Cl)cc1	ZINC000833169510	601388891	/nfs/dbraw/zinc/38/88/91/601388891.db2.gz	PXURRVIOTQXMEU-GFCCVEGCSA-N	-2	1	379.743	2.862	20	0		GFADML
Cc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)cc1C(=O)[O-]	ZINC000743266850	601484506	/nfs/dbraw/zinc/48/45/06/601484506.db2.gz	UWHRZGKVWWJJDK-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
CC(C)Oc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)[O-])cc1	ZINC000443365753	601575759	/nfs/dbraw/zinc/57/57/59/601575759.db2.gz	LATYPLYKNHAAPS-UHFFFAOYSA-N	-2	1	379.390	2.671	20	0		GFADML
Cc1cc(Br)ncc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1C	ZINC000832859732	601576792	/nfs/dbraw/zinc/57/67/92/601576792.db2.gz	VBDCJYGJOPSAFZ-UHFFFAOYSA-N	-2	1	385.239	2.960	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1C	ZINC000751145016	601833296	/nfs/dbraw/zinc/83/32/96/601833296.db2.gz	ADWMECMLCXDUOS-UHFFFAOYSA-N	-2	1	385.344	2.559	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(C(=O)N2CCCC2)cc1	ZINC000833294175	601857278	/nfs/dbraw/zinc/85/72/78/601857278.db2.gz	GZSGZXWAULMZJT-UHFFFAOYSA-N	-2	1	392.408	2.561	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1cccc(N2CCCCC2=O)c1	ZINC000833295541	601858773	/nfs/dbraw/zinc/85/87/73/601858773.db2.gz	ZGVBAEWPQMBMTM-UHFFFAOYSA-N	-2	1	392.408	2.842	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)c1	ZINC000476415936	601988439	/nfs/dbraw/zinc/98/84/39/601988439.db2.gz	DPLBNSHJTBNJKP-UHFFFAOYSA-N	-2	1	377.418	2.518	20	0		GFADML
CC(C)c1csc(C[N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2F)n1	ZINC000827144981	602010465	/nfs/dbraw/zinc/01/04/65/602010465.db2.gz	ZPSVVISUZJCISN-UHFFFAOYSA-N	-2	1	376.406	2.721	20	0		GFADML
C[C@@H](CC(=O)[O-])C(=O)Nc1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1	ZINC000827316591	602093254	/nfs/dbraw/zinc/09/32/54/602093254.db2.gz	BKJQMLCCKLRGCR-NSHDSACASA-N	-2	1	380.397	2.676	20	0		GFADML
CCCc1cc([N-]S(=O)(=O)c2cc(Br)cc(C(=O)[O-])c2)[nH]n1	ZINC000829566362	602306220	/nfs/dbraw/zinc/30/62/20/602306220.db2.gz	JJYISRVSKGMCPC-UHFFFAOYSA-N	-2	1	388.243	2.624	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2cc(CCc3ccccc3)n[nH]2)cc1	ZINC000833267245	602306843	/nfs/dbraw/zinc/30/68/43/602306843.db2.gz	ROUZGRROBYQHLF-UHFFFAOYSA-N	-2	1	385.445	2.623	20	0		GFADML
CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)cc1	ZINC000739209791	602655196	/nfs/dbraw/zinc/65/51/96/602655196.db2.gz	REPINAOUHMHRFZ-UHFFFAOYSA-N	-2	1	391.449	2.946	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(NC(=O)c3ccccc3)CC2)c([O-])c1	ZINC000740700226	602844754	/nfs/dbraw/zinc/84/47/54/602844754.db2.gz	TWALRYHDGXXWAZ-UHFFFAOYSA-N	-2	1	383.404	2.517	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2cccnc2OCC(F)(F)F)c([O-])c1	ZINC000740699317	602848021	/nfs/dbraw/zinc/84/80/21/602848021.db2.gz	XVZLKWBCHOEHMP-UHFFFAOYSA-N	-2	1	385.298	2.748	20	0		GFADML
COc1ccccc1N1CC[C@@H](CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000739977640	602857003	/nfs/dbraw/zinc/85/70/03/602857003.db2.gz	PYTFKVRAMWQUNK-ZDUSSCGKSA-N	-2	1	385.420	2.747	20	0		GFADML
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000739305115	602857040	/nfs/dbraw/zinc/85/70/40/602857040.db2.gz	LNHQNHGXXDUUCC-CHWSQXEVSA-N	-2	1	377.441	2.639	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)c([O-])c1	ZINC000740699716	602859663	/nfs/dbraw/zinc/85/96/63/602859663.db2.gz	XNBJLBNRNYLBNJ-INIZCTEOSA-N	-2	1	378.331	2.974	20	0		GFADML
CN(C(=O)c1ccc(NC(=O)[O-])cc1[O-])[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000739593587	602865529	/nfs/dbraw/zinc/86/55/29/602865529.db2.gz	IXLXXYBTVLJJLV-MRXNPFEDSA-N	-2	1	383.404	2.750	20	0		GFADML
CCc1cc2c(COC(=O)CCC(C)(C)NC(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000739543881	602897198	/nfs/dbraw/zinc/89/71/98/602897198.db2.gz	SBWGVPGONCRCRE-UHFFFAOYSA-N	-2	1	377.393	2.931	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC(N(CC2CC2)C(=O)[O-])CC1	ZINC000830704073	603467155	/nfs/dbraw/zinc/46/71/55/603467155.db2.gz	KPVZEFGOPYVKCM-UHFFFAOYSA-N	-2	1	390.484	2.783	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NCc1ccc(CCNC(=O)[O-])cc1	ZINC000830703473	603483681	/nfs/dbraw/zinc/48/36/81/603483681.db2.gz	FLNKTMUZTKOKJB-UHFFFAOYSA-N	-2	1	386.452	2.528	20	0		GFADML
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1cc(NC(=O)[O-])ccc1F	ZINC000828740687	603817705	/nfs/dbraw/zinc/81/77/05/603817705.db2.gz	UMKBFFOIQGTPIS-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
Cc1cc(C(=O)[O-])ccc1S(=O)(=O)[N-]c1cccc2c1CCN2C(=O)[O-]	ZINC000829972082	603838418	/nfs/dbraw/zinc/83/84/18/603838418.db2.gz	UWNZQSSMNAISSA-UHFFFAOYSA-N	-3	1	376.390	2.535	20	0		GFADML
CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000823816904	603910225	/nfs/dbraw/zinc/91/02/25/603910225.db2.gz	GSHLRQIRLLIPAR-FZMZJTMJSA-N	-2	1	393.440	2.905	20	0		GFADML
CCc1cc2c(COC(=O)c3ccc(CNC(=O)[O-])o3)cc(=O)oc2cc1[O-]	ZINC000827569079	604017235	/nfs/dbraw/zinc/01/72/35/604017235.db2.gz	IUGWUPHRVZCVER-UHFFFAOYSA-N	-2	1	387.344	2.779	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2cccc(CSCC(=O)[O-])c2)c1	ZINC000832095615	604634028	/nfs/dbraw/zinc/63/40/28/604634028.db2.gz	HWBPCRNHTYYQSL-UHFFFAOYSA-N	-2	1	397.474	2.822	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cccc(F)c1C(=O)[O-])c1nc(C2CCCCC2)no1	ZINC000833523325	605041043	/nfs/dbraw/zinc/04/10/43/605041043.db2.gz	MGEYUVRTIKZXMQ-SNVBAGLBSA-N	-2	1	397.428	2.994	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)Nc2ccc(C(C)(C)C(=O)[O-])cc2)cc1C(=O)[O-]	ZINC000753779514	605166922	/nfs/dbraw/zinc/16/69/22/605166922.db2.gz	KUWLONGLTUSQMO-UHFFFAOYSA-N	-2	1	395.408	2.995	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2C[C@@H](O)C[C@H]2c2ccc(F)c(F)c2)c([O-])c1	ZINC000834256955	605661985	/nfs/dbraw/zinc/66/19/85/605661985.db2.gz	PSHKELUPZQUXIV-NHYWBVRUSA-N	-2	1	378.331	2.708	20	0		GFADML
CC1(C)Cc2cc(S(=O)(=O)[N-]c3nc4cccc(C(=O)[O-])c4[nH]3)ccc2O1	ZINC000833562180	605784678	/nfs/dbraw/zinc/78/46/78/605784678.db2.gz	LQCRWGBQVIDYRJ-UHFFFAOYSA-N	-2	1	387.417	2.775	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])[C@@H](C)CN1C(=O)[O-]	ZINC000833835702	605837134	/nfs/dbraw/zinc/83/71/34/605837134.db2.gz	CSFJCDPPNAHFFE-RYUDHWBXSA-N	-2	1	393.440	2.952	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(NC(N)=O)cc2)cc(C(=O)[O-])c1Cl	ZINC000759095550	655947425	/nfs/dbraw/zinc/94/74/25/655947425.db2.gz	PCVTZKLKJUWCGD-UHFFFAOYSA-N	-2	1	383.813	2.638	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc3c(c2)CC(=O)N3)cc(C(=O)[O-])c1Cl	ZINC000759100627	655947670	/nfs/dbraw/zinc/94/76/70/655947670.db2.gz	DNXCYYYLURRFAP-UHFFFAOYSA-N	-2	1	380.809	2.642	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1cccc(F)c1	ZINC000776473940	656744928	/nfs/dbraw/zinc/74/49/28/656744928.db2.gz	BPLLMDPLXJDGCH-SNVBAGLBSA-N	-2	1	379.196	2.632	20	0		GFADML
O=C([O-])[C@H](Cc1ccc(F)cc1)[N-]S(=O)(=O)c1c(Cl)ccnc1Cl	ZINC000776621871	656768871	/nfs/dbraw/zinc/76/88/71/656768871.db2.gz	GUVMABKVJUBEQJ-NSHDSACASA-N	-2	1	393.223	2.502	20	0		GFADML
CCn1c(=O)c2ccc(C(=O)Nc3nc(Cl)ccc3[O-])cc2[n-]c1=S	ZINC000790048046	657919718	/nfs/dbraw/zinc/91/97/18/657919718.db2.gz	PNQXNZLMAPAWFD-UHFFFAOYSA-N	-2	1	376.825	2.711	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)cc(C(=O)[O-])c1	ZINC000795365196	658811392	/nfs/dbraw/zinc/81/13/92/658811392.db2.gz	HRDLTHVONSZMAN-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
C[C@H](O)c1cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)ccc1F	ZINC000795380395	658812879	/nfs/dbraw/zinc/81/28/79/658812879.db2.gz	LAUOVFNFCASUGA-ZETCQYMHSA-N	-2	1	375.324	2.656	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)C(=O)OC2	ZINC000808126103	659879217	/nfs/dbraw/zinc/87/92/17/659879217.db2.gz	SYUYPUPNLNPKEQ-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000846770458	661565463	/nfs/dbraw/zinc/56/54/63/661565463.db2.gz	BIIUSZMZYYHBTD-XHNCKOQMSA-N	-2	1	381.281	2.802	20	0		GFADML
C[C@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])oc1Br)CC(F)(F)F	ZINC000396906075	677411743	/nfs/dbraw/zinc/41/17/43/677411743.db2.gz	FCDLPYKKUOWTLU-YFKPBYRVSA-N	-2	1	394.165	2.607	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-][C@H]2CCCC2(F)F)c(Br)s1	ZINC000398077067	677411858	/nfs/dbraw/zinc/41/18/58/677411858.db2.gz	DVLFQEWQOHKTHL-ZETCQYMHSA-N	-2	1	390.227	2.675	20	0		GFADML
O=C(Nc1ccc(-c2nc(=O)o[n-]2)cc1)c1cc(Br)ccc1[O-]	ZINC000170748145	551638515	/nfs/dbraw/zinc/63/85/15/551638515.db2.gz	WUBUZGCQBCFQHD-UHFFFAOYSA-N	-2	1	376.166	2.750	20	0		GFADML
Cc1cc(C)c([N-]S(=O)(=O)c2cc(C(=O)[O-])n(C)c2)cc1Br	ZINC000185978033	552376417	/nfs/dbraw/zinc/37/64/17/552376417.db2.gz	QJCSCJMXDPDZIC-UHFFFAOYSA-N	-2	1	387.255	2.903	20	0		GFADML
COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)[N-][C@@H](CC(C)C)C(=O)[O-]	ZINC000263565311	553189565	/nfs/dbraw/zinc/18/95/65/553189565.db2.gz	VOBDSJJHAFVEMI-NSHDSACASA-N	-2	1	398.264	2.558	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)[C@H]1CCOC2(CCC2)C1	ZINC000372262906	563300414	/nfs/dbraw/zinc/30/04/14/563300414.db2.gz	TWCLRHBIHIONSJ-GXFFZTMASA-N	-2	1	391.848	2.560	20	0		GFADML
C[C@@H]1C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(Cl)c3)cc21	ZINC000326791611	563456115	/nfs/dbraw/zinc/45/61/15/563456115.db2.gz	QFWWTNQDMCANQF-QMMMGPOBSA-N	-2	1	380.809	2.895	20	0		GFADML
COC(=O)c1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(C(=O)[O-])c1F	ZINC000427301391	563464976	/nfs/dbraw/zinc/46/49/76/563464976.db2.gz	XKUAGLOALXEMBJ-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(O)c2)c(Br)c1	ZINC000386379084	563518809	/nfs/dbraw/zinc/51/88/09/563518809.db2.gz	HSQPHIMCXAFVTN-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
CC(C)(C)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2n[nH]nc2c1	ZINC000446618689	563866764	/nfs/dbraw/zinc/86/67/64/563866764.db2.gz	AFYZTBYDJPLTJN-UHFFFAOYSA-N	-2	1	380.451	2.816	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(F)c2)cc1F	ZINC000509608919	564305602	/nfs/dbraw/zinc/30/56/02/564305602.db2.gz	FCNDZOAEWXLATH-UHFFFAOYSA-N	-2	1	377.752	2.882	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2[nH]c(=O)oc2c1	ZINC000475742992	564316892	/nfs/dbraw/zinc/31/68/92/564316892.db2.gz	VROAUXFLBASOHP-UHFFFAOYSA-N	-2	1	382.781	2.994	20	0		GFADML
COC(=O)Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000477414782	564375781	/nfs/dbraw/zinc/37/57/81/564375781.db2.gz	GZDRYZYANNRQFQ-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
C[C@H](CC(=O)[O-])[N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl	ZINC000479196283	564431107	/nfs/dbraw/zinc/43/11/07/564431107.db2.gz	YNAQCBVDWKXODT-RXMQYKEDSA-N	-2	1	391.070	2.897	20	0		GFADML
Cc1ccc([C@H]([N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C(=O)[O-])cc1	ZINC000547547868	564493232	/nfs/dbraw/zinc/49/32/32/564493232.db2.gz	DCHOFPSVOSNDJD-ZDUSSCGKSA-N	-2	1	384.797	2.661	20	0		GFADML
O=C([O-])[C@H](CC(F)F)[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000548534986	564556423	/nfs/dbraw/zinc/55/64/23/564556423.db2.gz	JSHQQWNORKXCFZ-VKHMYHEASA-N	-2	1	398.634	2.551	20	0		GFADML
C[C@H](CC[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)CC(=O)[O-]	ZINC000548564054	564561023	/nfs/dbraw/zinc/56/10/23/564561023.db2.gz	RHSAQZODSNRKDX-SSDOTTSWSA-N	-2	1	386.214	2.507	20	0		GFADML
C[C@@H](C(=O)[O-])[C@H](C)[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F	ZINC000571997152	564576380	/nfs/dbraw/zinc/57/63/80/564576380.db2.gz	UDFGQLLRMMIWCX-RITPCOANSA-N	-2	1	388.642	2.629	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F)C(F)F	ZINC000572042228	564579216	/nfs/dbraw/zinc/57/92/16/564579216.db2.gz	LOGLKUWZRQGTLQ-LURJTMIESA-N	-2	1	395.733	2.993	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2c(C)ccc(Cl)c2C(=O)[O-])cc1	ZINC000484815150	564599842	/nfs/dbraw/zinc/59/98/42/564599842.db2.gz	RXBANMONTOCIIE-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000484965511	564603225	/nfs/dbraw/zinc/60/32/25/564603225.db2.gz	YKUVJFGXHQJMQQ-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
O=C([O-])[C@H](Cc1ccc(F)cc1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000577598599	564736898	/nfs/dbraw/zinc/73/68/98/564736898.db2.gz	WTJBJDDSHVGTGD-ZDUSSCGKSA-N	-2	1	375.780	2.592	20	0		GFADML
NC(=O)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cs2)c(Cl)cc1Cl	ZINC000581502044	564805606	/nfs/dbraw/zinc/80/56/06/564805606.db2.gz	VZRKZSIVKXDLAB-UHFFFAOYSA-N	-2	1	395.245	2.653	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1	ZINC000684894609	565086725	/nfs/dbraw/zinc/08/67/25/565086725.db2.gz	DKUZJFLYXGABML-UHFFFAOYSA-N	-2	1	382.825	2.500	20	0		GFADML
O=C([O-])CCC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1	ZINC000680997842	566090135	/nfs/dbraw/zinc/09/01/35/566090135.db2.gz	URWROQDRDPWJLR-UHFFFAOYSA-N	-2	1	382.825	2.944	20	0		GFADML
CSc1cccc(N(C)C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000738215166	599770476	/nfs/dbraw/zinc/77/04/76/599770476.db2.gz	TYFPNANWOBCQPT-UHFFFAOYSA-N	-2	1	397.456	2.791	20	0		GFADML
CN(C(=O)c1cccc(S(=O)(=O)[N-]c2ccc(F)cc2)c1)C(C)(C)C(=O)[O-]	ZINC000485364898	599847721	/nfs/dbraw/zinc/84/77/21/599847721.db2.gz	AFZLAPSIAXBXFX-UHFFFAOYSA-N	-2	1	394.424	2.562	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1	ZINC000609218927	599854640	/nfs/dbraw/zinc/85/46/40/599854640.db2.gz	BJAOBSAOVWSBBN-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)c1	ZINC000737694745	599854938	/nfs/dbraw/zinc/85/49/38/599854938.db2.gz	DWELQJQOYBLKFS-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
O=C([O-])CSCc1cccc([N-]S(=O)(=O)c2ccc3c(c2)OCCO3)c1	ZINC000739873579	599928003	/nfs/dbraw/zinc/92/80/03/599928003.db2.gz	HMDKIXKFCBIPPE-UHFFFAOYSA-N	-2	1	395.458	2.576	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2ccc(F)cc2)c(F)c1	ZINC000737888558	599939476	/nfs/dbraw/zinc/93/94/76/599939476.db2.gz	CFRUCBWLTKTSKR-CQSZACIVSA-N	-2	1	389.351	2.607	20	0		GFADML
CC(C)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736396512	599952523	/nfs/dbraw/zinc/95/25/23/599952523.db2.gz	WJJZQTVSTFKZJH-MSOLQXFVSA-N	-2	1	385.464	2.737	20	0		GFADML
COc1ccc(C(=O)[O-])c(NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)c1	ZINC000737939375	600006694	/nfs/dbraw/zinc/00/66/94/600006694.db2.gz	GNYSTCSCXUQBDP-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000115680274	600482261	/nfs/dbraw/zinc/48/22/61/600482261.db2.gz	APGKEGJBUGPWHP-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2ccc(N3CCOC3=O)cc2)ccc1Cl	ZINC000738672220	600693559	/nfs/dbraw/zinc/69/35/59/600693559.db2.gz	OBUVTEYLXMCFHR-UHFFFAOYSA-N	-2	1	396.808	2.796	20	0		GFADML
COC(=O)C(C)(C)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1	ZINC000572774516	600899412	/nfs/dbraw/zinc/89/94/12/600899412.db2.gz	NOKQVDLRSRSHSY-UHFFFAOYSA-N	-2	1	391.445	2.945	20	0		GFADML
CC(C)(O)COc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)cc1	ZINC000489745872	601223979	/nfs/dbraw/zinc/22/39/79/601223979.db2.gz	ZYQHJLDDUVLEDO-UHFFFAOYSA-N	-2	1	399.852	2.989	20	0		GFADML
COc1cc(S(=O)(=O)Nc2ccc(C)cc2C(=O)[O-])c(Cl)cc1C(=O)[O-]	ZINC000485291140	601224011	/nfs/dbraw/zinc/22/40/11/601224011.db2.gz	KNTIMXTWRXMLAB-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3cc(C(=O)[O-])ccc3C)ccc2o1	ZINC000831832118	601230377	/nfs/dbraw/zinc/23/03/77/601230377.db2.gz	VIVIQIMZMZFFDN-UHFFFAOYSA-N	-2	1	376.390	2.782	20	0		GFADML
COC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(C=CC(=O)[O-])cc2)c1	ZINC000831210945	601325169	/nfs/dbraw/zinc/32/51/69/601325169.db2.gz	XMSCZKUAYMRTFQ-JXMROGBWSA-N	-2	1	376.390	2.764	20	0		GFADML
CNC(=O)c1cc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)ccc1Cl	ZINC000831005458	601326187	/nfs/dbraw/zinc/32/61/87/601326187.db2.gz	NLKSDDGPONJNIV-RUDMXATFSA-N	-2	1	394.836	2.598	20	0		GFADML
CC(C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1	ZINC000826976431	601326222	/nfs/dbraw/zinc/32/62/22/601326222.db2.gz	YAAFANKHFQHBBJ-LFYBBSHMSA-N	-2	1	388.445	2.723	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(Cl)c(C(=O)[O-])c1	ZINC000042796592	601326448	/nfs/dbraw/zinc/32/64/48/601326448.db2.gz	NIRQLFIYGWSYLW-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000829799319	601327780	/nfs/dbraw/zinc/32/77/80/601327780.db2.gz	HFRRWZLSVSCHGI-DHZHZOJOSA-N	-2	1	389.433	2.727	20	0		GFADML
Cc1nc(-c2ccc([N-]S(=O)(=O)c3ccc(C=CC(=O)[O-])cc3)cc2)n[nH]1	ZINC000832989858	601329313	/nfs/dbraw/zinc/32/93/13/601329313.db2.gz	IEYHWFMXEGVKCM-WCIBSUBMSA-N	-2	1	384.417	2.679	20	0		GFADML
COC(=O)C(C)(C)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000738029506	601332684	/nfs/dbraw/zinc/33/26/84/601332684.db2.gz	NGANATBEBLEFPG-UHFFFAOYSA-N	-2	1	395.408	2.775	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3ccc(C(=O)[O-])cc3C)ccc2o1	ZINC000831795867	601795228	/nfs/dbraw/zinc/79/52/28/601795228.db2.gz	PENBIKFOPIZOBV-UHFFFAOYSA-N	-2	1	390.417	2.824	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000829799097	601827654	/nfs/dbraw/zinc/82/76/54/601827654.db2.gz	CYOQWBQZRWGGGC-UHFFFAOYSA-N	-2	1	396.852	2.897	20	0		GFADML
CC1(C)Cc2cc(S(=O)(=O)[N-]c3cccc(OCC(=O)[O-])c3)ccc2O1	ZINC000828081881	601830765	/nfs/dbraw/zinc/83/07/65/601830765.db2.gz	DSKITWVNXJRJSO-UHFFFAOYSA-N	-2	1	377.418	2.664	20	0		GFADML
CC[C@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000828758739	601859423	/nfs/dbraw/zinc/85/94/23/601859423.db2.gz	OAZUPQAQMIVRGM-NSHDSACASA-N	-2	1	394.424	2.853	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)cc(C(=O)[O-])c1F	ZINC000326972596	601982723	/nfs/dbraw/zinc/98/27/23/601982723.db2.gz	QTMQYZRNJVIVTO-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)cc(C(=O)[O-])c1F	ZINC000832904451	601985029	/nfs/dbraw/zinc/98/50/29/601985029.db2.gz	OHSIEBVFYXLICS-UHFFFAOYSA-N	-3	1	396.396	2.743	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)cc(C(=O)[O-])c1F	ZINC000832904426	601985138	/nfs/dbraw/zinc/98/51/38/601985138.db2.gz	MYHRVTGBDLIYQY-UHFFFAOYSA-N	-3	1	381.381	2.650	20	0		GFADML
Cc1nc(C)n(-c2ccccc2[N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)n1	ZINC000477458295	601989086	/nfs/dbraw/zinc/98/90/86/601989086.db2.gz	VCWHQYVZUCIBQF-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
CC(C)c1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])cc(S(C)(=O)=O)c2)cc1	ZINC000476396283	602122387	/nfs/dbraw/zinc/12/23/87/602122387.db2.gz	HKHNBGZJZCHJDQ-UHFFFAOYSA-N	-2	1	397.474	2.713	20	0		GFADML
COc1cc(F)c([N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)cc1F	ZINC000832010630	602122442	/nfs/dbraw/zinc/12/24/42/602122442.db2.gz	KGGNGGFQDNKLMT-UHFFFAOYSA-N	-2	1	379.287	2.751	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3nc(-c4ccccn4)[nH]c3c2)o1	ZINC000833323305	602175877	/nfs/dbraw/zinc/17/58/77/602175877.db2.gz	ALDNFTIDVQHAOA-UHFFFAOYSA-N	-2	1	384.373	2.717	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c([O-])c1	ZINC000740699619	602844370	/nfs/dbraw/zinc/84/43/70/602844370.db2.gz	TVZZAFCGPRIWKK-UHFFFAOYSA-N	-2	1	383.404	2.517	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NCC2CCN(C(=O)[O-])CC2)c([O-])c1	ZINC000738723422	602855872	/nfs/dbraw/zinc/85/58/72/602855872.db2.gz	QAINPBFTDRVPFH-UHFFFAOYSA-N	-2	1	393.440	2.859	20	0		GFADML
CC(C)(C)OC(=O)NCC1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000738717646	602856189	/nfs/dbraw/zinc/85/61/89/602856189.db2.gz	UFACVJUSLPDHIH-UHFFFAOYSA-N	-2	1	393.440	2.859	20	0		GFADML
O=C([O-])NC[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C1CC1	ZINC000740611839	603069416	/nfs/dbraw/zinc/06/94/16/603069416.db2.gz	HMRADGWZSSLONB-JTQLQIEISA-N	-2	1	386.779	2.683	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@@H](CNC(=O)[O-])C2CC2)c([O-])c1	ZINC000738723052	603103295	/nfs/dbraw/zinc/10/32/95/603103295.db2.gz	LOLUHBWQSUFZCR-ZDUSSCGKSA-N	-2	1	379.413	2.515	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@H](CNC(=O)[O-])C2CC2)c([O-])c1	ZINC000738723051	603103316	/nfs/dbraw/zinc/10/33/16/603103316.db2.gz	LOLUHBWQSUFZCR-CYBMUJFWSA-N	-2	1	379.413	2.515	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN(C(=O)[O-])C3)cc1F	ZINC000739934269	603182521	/nfs/dbraw/zinc/18/25/21/603182521.db2.gz	ZDDAWZMYTLPDBH-UHFFFAOYSA-N	-2	1	380.397	2.671	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc([C@@H](C)NC(=O)[O-])cc1	ZINC000830234268	603404213	/nfs/dbraw/zinc/40/42/13/603404213.db2.gz	PUKXKHYNPYSIFE-LLVKDONJSA-N	-3	1	378.406	2.823	20	0		GFADML
Cc1ccc(F)c([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)c1C(=O)[O-]	ZINC000832935678	604890388	/nfs/dbraw/zinc/89/03/88/604890388.db2.gz	IQPMHFJBEPFPAB-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](CCC(=O)[O-])Cc2ccccc2)c(F)c1	ZINC000833729646	605028036	/nfs/dbraw/zinc/02/80/36/605028036.db2.gz	RUIXBERQGOVGGV-ZDUSSCGKSA-N	-2	1	399.415	2.728	20	0		GFADML
COc1c(F)cc([N-]S(=O)(=O)c2ccc(C3(C(=O)[O-])CC3)cc2)cc1F	ZINC000833727477	605124673	/nfs/dbraw/zinc/12/46/73/605124673.db2.gz	XJGQRDFFAWVDNZ-UHFFFAOYSA-N	-2	1	383.372	2.890	20	0		GFADML
O=C([O-])N1CCC2(CCN(C(=O)c3ccc(Br)cc3[O-])C2)CC1	ZINC000834091543	605909195	/nfs/dbraw/zinc/90/91/95/605909195.db2.gz	UYIDGPCLIOZHEH-UHFFFAOYSA-N	-2	1	383.242	2.761	20	0		GFADML
O=C([O-])NCCOc1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)cc1	ZINC000834245183	606081137	/nfs/dbraw/zinc/08/11/37/606081137.db2.gz	IXUSEOLXKHQFMZ-UHFFFAOYSA-N	-2	1	390.339	2.551	20	0		GFADML
O=S(=O)([N-]c1ncc(-c2nn[n-]n2)s1)c1cc2cc(Cl)ccc2s1	ZINC000823589011	660375759	/nfs/dbraw/zinc/37/57/59/660375759.db2.gz	HWCJELILLCCMFH-UHFFFAOYSA-N	-2	1	398.882	2.992	20	0		GFADML
Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000057115670	654800628	/nfs/dbraw/zinc/80/06/28/654800628.db2.gz	SKEAJRGXRPTWRQ-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
O=C(CCOc1ccccc1)[N-][N-]S(=O)(=O)c1cc(Cl)sc1Cl	ZINC000060838613	654833317	/nfs/dbraw/zinc/83/33/17/654833317.db2.gz	SFKJXJVEHMKVMP-UHFFFAOYSA-N	-2	1	395.289	2.834	20	0		GFADML
CSCC[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C(=O)[O-]	ZINC000274918485	655207303	/nfs/dbraw/zinc/20/73/03/655207303.db2.gz	MJUJOMZBZPWRAY-VIFPVBQESA-N	-2	1	391.820	2.843	20	0		GFADML
O=C(NN=c1[n-]nc(-c2ccccn2)s1)c1ccc(Br)c([O-])c1	ZINC000188242355	655378987	/nfs/dbraw/zinc/37/89/87/655378987.db2.gz	IPYIYNOLTNWVKO-UHFFFAOYSA-N	-2	1	392.238	2.825	20	0		GFADML
O=C([O-])c1cc(N2CCCC2)ccc1[N-]S(=O)(=O)c1ccc(Cl)nc1	ZINC000758162086	655924742	/nfs/dbraw/zinc/92/47/42/655924742.db2.gz	HVUGPEPCUMJMGY-UHFFFAOYSA-N	-2	1	381.841	2.834	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2cc(C)c(Cl)c(C(=O)[O-])c2)cc1	ZINC000759093458	655947132	/nfs/dbraw/zinc/94/71/32/655947132.db2.gz	BJQOXXCLJDGIMH-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
CC[C@H](C[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)C(=O)[O-]	ZINC000788082034	657647903	/nfs/dbraw/zinc/64/79/03/657647903.db2.gz	CUSINBLBUUFRKT-ZCFIWIBFSA-N	-2	1	388.642	2.631	20	0		GFADML
O=C(NC1CCSCC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000299592703	563387017	/nfs/dbraw/zinc/38/70/17/563387017.db2.gz	DMTCFSFFOKPLON-UHFFFAOYSA-N	-2	1	398.531	2.880	20	0		GFADML
O=C([O-])c1ccc([O-])c(S(=O)(=O)Nc2cccc(CC(F)(F)F)c2)c1	ZINC000436995149	563687799	/nfs/dbraw/zinc/68/77/99/563687799.db2.gz	PIMDAFZMMRKCMH-UHFFFAOYSA-N	-2	1	375.324	2.996	20	0		GFADML
O=S(=O)([N-]c1cccc([N-]S(=O)(=O)c2ccccc2)c1)c1ccoc1	ZINC000506707137	564209938	/nfs/dbraw/zinc/20/99/38/564209938.db2.gz	JJHGDTOAOZFXQX-UHFFFAOYSA-N	-2	1	378.431	2.881	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc3scnc3c2)ccc1OCC(=O)[O-]	ZINC000509575480	564304109	/nfs/dbraw/zinc/30/41/09/564304109.db2.gz	WGFIIMXLPOZPKL-UHFFFAOYSA-N	-2	1	378.431	2.869	20	0		GFADML
COc1c(F)cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2C)cc1F	ZINC000509588035	564304990	/nfs/dbraw/zinc/30/49/90/564304990.db2.gz	UDWKVKRJTAHNQK-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1NS(=O)(=O)c1csc(C(=O)[O-])c1	ZINC000475751051	564318148	/nfs/dbraw/zinc/31/81/48/564318148.db2.gz	ROEXAJZDMDEXOQ-UHFFFAOYSA-N	-2	1	375.811	2.907	20	0		GFADML
CC(C)(CC(=O)[O-])[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F	ZINC000567298136	564364802	/nfs/dbraw/zinc/36/48/02/564364802.db2.gz	VPZHLNUIOWCLBC-UHFFFAOYSA-N	-2	1	388.642	2.773	20	0		GFADML
O=C(N[C@@H]1C[C@H]1C1CC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000568831776	564437071	/nfs/dbraw/zinc/43/70/71/564437071.db2.gz	TWYOBWKYHYLPJT-UONOGXRCSA-N	-2	1	378.475	2.783	20	0		GFADML
CSCc1ccccc1[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000546072329	564443029	/nfs/dbraw/zinc/44/30/29/564443029.db2.gz	OJIUPSVNPFJCOE-UHFFFAOYSA-N	-3	1	381.431	2.747	20	0		GFADML
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(C(=O)[O-])c2)c(Cl)cc1F	ZINC000569780375	564477689	/nfs/dbraw/zinc/47/76/89/564477689.db2.gz	LBVNZOYSTBIWHN-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1Cl	ZINC000516020389	564491104	/nfs/dbraw/zinc/49/11/04/564491104.db2.gz	XYHPQBXDKCTNIW-UHFFFAOYSA-N	-2	1	385.825	2.864	20	0		GFADML
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1c(Cl)cccc1C(=O)[O-]	ZINC000547547360	564493619	/nfs/dbraw/zinc/49/36/19/564493619.db2.gz	XAAVCCFDKRWJOZ-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CC(=O)NCc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)s1	ZINC000547572051	564495769	/nfs/dbraw/zinc/49/57/69/564495769.db2.gz	DZWZWCDHDIWYJK-UHFFFAOYSA-N	-2	1	388.854	2.537	20	0		GFADML
O=C([O-])CC1(C[N-]S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CCCCC1	ZINC000547580790	564497135	/nfs/dbraw/zinc/49/71/35/564497135.db2.gz	BSIIJFBVIBGNHH-UHFFFAOYSA-N	-2	1	390.845	2.952	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C(F)(F)F)c2)cn1	ZINC000532845248	564947391	/nfs/dbraw/zinc/94/73/91/564947391.db2.gz	WQQMWXMOXKISDU-UHFFFAOYSA-N	-2	1	376.312	2.608	20	0		GFADML
COc1cc(OC)c([N-]S(=O)(=O)C[C@H]2CCCC2(F)F)c(C(=O)[O-])c1	ZINC000654768106	566020786	/nfs/dbraw/zinc/02/07/86/566020786.db2.gz	KACKHFQMVAJXHL-SECBINFHSA-N	-2	1	379.381	2.579	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]C[C@@]2(CC(=O)[O-])CC[C@@H](C)C2)c(F)c1	ZINC000681581182	566115519	/nfs/dbraw/zinc/11/55/19/566115519.db2.gz	XSDJLKJGAVVQNO-HWPZZCPQSA-N	-2	1	377.409	2.533	20	0		GFADML
O=C([O-])[C@@H]1CCCCN1C(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000262702636	597441352	/nfs/dbraw/zinc/44/13/52/597441352.db2.gz	ZNDHITHTWLALBL-KRWDZBQOSA-N	-2	1	388.445	2.567	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N(CC3CC3)C3CCCCC3)cc2)[n-]1	ZINC000739874609	599749727	/nfs/dbraw/zinc/74/97/27/599749727.db2.gz	SWGYZQVAUHSOCQ-UHFFFAOYSA-N	-2	1	397.475	2.978	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(C(=O)NC[C@H](C)C(=O)[O-])ccc2C)c1	ZINC000262485038	599775659	/nfs/dbraw/zinc/77/56/59/599775659.db2.gz	FFAUYARREYQSAZ-AWEZNQCLSA-N	-2	1	390.461	2.555	20	0		GFADML
CSc1ccc([C@H](CC(=O)[O-])NC(=O)c2nc3ccccc3c(=O)[n-]2)cc1	ZINC000738203417	599881125	/nfs/dbraw/zinc/88/11/25/599881125.db2.gz	XWDZGISVTIHFQS-HNNXBMFYSA-N	-2	1	383.429	2.591	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1C(=O)NC(C)C	ZINC000268635670	599907575	/nfs/dbraw/zinc/90/75/75/599907575.db2.gz	QBHYFZBIUTYPHX-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
COC(=O)c1ccc(C(=O)[O-])c(S(=O)(=O)[N-]c2cccc([C@@H](C)OC)c2)c1	ZINC000737681637	599981765	/nfs/dbraw/zinc/98/17/65/599981765.db2.gz	KBEAQQPCNODADK-LLVKDONJSA-N	-2	1	393.417	2.680	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(SC)cc2)cc(C(=O)[O-])c1	ZINC000737665979	600022002	/nfs/dbraw/zinc/02/20/02/600022002.db2.gz	RCACFPCBRKDXCO-UHFFFAOYSA-N	-2	1	381.431	2.694	20	0		GFADML
COC(=O)c1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cccc(CSC)c2)c1	ZINC000737654118	600053110	/nfs/dbraw/zinc/05/31/10/600053110.db2.gz	LWMDBUIJWVDSCU-UHFFFAOYSA-N	-2	1	395.458	2.835	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2C(=O)[O-])cc1	ZINC000740154586	600058334	/nfs/dbraw/zinc/05/83/34/600058334.db2.gz	HBQWSSSOIXTQML-UHFFFAOYSA-N	-3	1	389.307	2.903	20	0		GFADML
CC(C)[C@H]1CCC[C@@H](NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736394128	600077992	/nfs/dbraw/zinc/07/79/92/600077992.db2.gz	GMBXZSDSGBLBTL-JKSUJKDBSA-N	-2	1	385.464	2.737	20	0		GFADML
COC(=O)c1ccc(C(=O)[O-])c(S(=O)(=O)[N-]c2ccc(CSC)cc2)c1	ZINC000737680420	600102300	/nfs/dbraw/zinc/10/23/00/600102300.db2.gz	FJGIAOQGWALJAS-UHFFFAOYSA-N	-2	1	395.458	2.835	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cccs1)c1nc(-c2ccc(C(=O)[O-])cc2)no1	ZINC000736671811	600112330	/nfs/dbraw/zinc/11/23/30/600112330.db2.gz	YWPJYBFITLUDLC-VIFPVBQESA-N	-2	1	379.419	2.536	20	0		GFADML
CCN(C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)[C@@H]1CCCC[C@@H]1C	ZINC000737059038	600121055	/nfs/dbraw/zinc/12/10/55/600121055.db2.gz	ZGCCNNZREBAFNX-KBXCAEBGSA-N	-2	1	385.464	2.834	20	0		GFADML
Cc1c(C[S@@](C)=O)cccc1[N-]S(=O)(=O)c1cc(F)ccc1C(=O)[O-]	ZINC000738290643	600254910	/nfs/dbraw/zinc/25/49/10/600254910.db2.gz	UBSYCOCOGJANSK-XMMPIXPASA-N	-2	1	385.438	2.512	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)cc1OC	ZINC000738064213	600301225	/nfs/dbraw/zinc/30/12/25/600301225.db2.gz	UEQGOKQMWDPVKU-UHFFFAOYSA-N	-2	1	380.422	2.614	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(-c2nc[nH]n2)cc1	ZINC000740134630	600392457	/nfs/dbraw/zinc/39/24/57/600392457.db2.gz	HGVQXAHEODRCNH-UHFFFAOYSA-N	-2	1	378.797	2.624	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])c1	ZINC000737143060	600396208	/nfs/dbraw/zinc/39/62/08/600396208.db2.gz	PQUCNMGIXNUXEY-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
Cc1ccc([C@@H](C)CNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)cc1	ZINC000738551573	600414108	/nfs/dbraw/zinc/41/41/08/600414108.db2.gz	KBEZKRUBFDLSLU-HNNXBMFYSA-N	-2	1	393.443	2.635	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(OCCCC(=O)[O-])cc2)cc1	ZINC000737703140	600488089	/nfs/dbraw/zinc/48/80/89/600488089.db2.gz	TWYJDFXVYBFSOR-UHFFFAOYSA-N	-2	1	393.417	2.518	20	0		GFADML
Cc1nc2cc(F)cc(C(=O)[N-]c3nnc(CCC(=O)[O-])s3)c2nc1C	ZINC000738873619	600634401	/nfs/dbraw/zinc/63/44/01/600634401.db2.gz	ZACVZIZQAOMCGU-UHFFFAOYSA-N	-2	1	375.385	2.507	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3cccc(F)c3C(=O)[O-])cc21	ZINC000377754906	600634797	/nfs/dbraw/zinc/63/47/97/600634797.db2.gz	YRHJLVWZFNSXDH-UHFFFAOYSA-N	-2	1	392.408	2.624	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)ccc1C	ZINC000736161471	600635608	/nfs/dbraw/zinc/63/56/08/600635608.db2.gz	UUJYPHLDVCRRJS-UHFFFAOYSA-N	-2	1	391.449	2.864	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cccc(Cl)c2C)cc1C(=O)[O-]	ZINC000831434862	600688385	/nfs/dbraw/zinc/68/83/85/600688385.db2.gz	HSHLGNIDPFYZAP-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(Cl)cc2C)ccc1C(=O)[O-]	ZINC000831327705	600689382	/nfs/dbraw/zinc/68/93/82/600689382.db2.gz	LCRIYLVRCWFYLG-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(C)c(F)c(C)c2)cc1C(=O)[O-]	ZINC000831435121	600689836	/nfs/dbraw/zinc/68/98/36/600689836.db2.gz	PJLAPNDBDDDTNW-UHFFFAOYSA-N	-2	1	381.381	2.728	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc1C	ZINC000737701384	600894897	/nfs/dbraw/zinc/89/48/97/600894897.db2.gz	FOQVWVGCGZWTRS-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cn1ccnc1COc1ccc([N-]S(=O)(=O)c2csc(C(=O)[O-])c2)cc1	ZINC000833057787	600979008	/nfs/dbraw/zinc/97/90/08/600979008.db2.gz	JETVYNWYTSFZIH-UHFFFAOYSA-N	-2	1	393.446	2.560	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)cc1	ZINC000736123071	601050181	/nfs/dbraw/zinc/05/01/81/601050181.db2.gz	CGSAAZUZXHVLLR-UHFFFAOYSA-N	-2	1	391.449	2.580	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(O[C@H]3CCCC[C@H]3O)cc2)cs1	ZINC000555460806	601203589	/nfs/dbraw/zinc/20/35/89/601203589.db2.gz	PPHZSAAJFGYNGN-CABCVRRESA-N	-2	1	397.474	2.929	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)c1ccc(/C=C/C(=O)[O-])cc1	ZINC000830232465	601251056	/nfs/dbraw/zinc/25/10/56/601251056.db2.gz	XVKWQWSFGAAFBH-BJMVGYQFSA-N	-3	1	375.402	2.846	20	0		GFADML
CCc1nc(C2([N-]S(=O)(=O)c3ccc(C(=O)[O-])cc3Cl)CCCC2)no1	ZINC000830309912	601265649	/nfs/dbraw/zinc/26/56/49/601265649.db2.gz	SBYGJVAZIRCUAZ-UHFFFAOYSA-N	-2	1	399.856	2.731	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1C(=O)NC(C)C	ZINC000731178635	601331674	/nfs/dbraw/zinc/33/16/74/601331674.db2.gz	TYZFVSZAGIMPRT-UHFFFAOYSA-N	-2	1	394.424	2.771	20	0		GFADML
CC[C@@](C)(CC(=O)[O-])NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000767052313	601468789	/nfs/dbraw/zinc/46/87/89/601468789.db2.gz	SEQLXOKWTXLQTO-IBGZPJMESA-N	-2	1	390.461	2.861	20	0		GFADML
CC(C)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)c(C(=O)[O-])c1	ZINC000827124875	601474856	/nfs/dbraw/zinc/47/48/56/601474856.db2.gz	SKCFCABLKGSOAN-UHFFFAOYSA-N	-3	1	377.418	2.936	20	0		GFADML
CC(C)c1cc([N-]S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)[nH]n1	ZINC000388334710	601629283	/nfs/dbraw/zinc/62/92/83/601629283.db2.gz	LCAHKYYKZKXAIB-UHFFFAOYSA-N	-2	1	388.243	2.795	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cnn(-c3ccncc3)c2)c(Cl)cc1F	ZINC000727113819	601769122	/nfs/dbraw/zinc/76/91/22/601769122.db2.gz	SDHKVHABSQRTKZ-UHFFFAOYSA-N	-2	1	396.787	2.559	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(N3CCOC3=O)c2)ccc1Cl	ZINC000031720117	601826998	/nfs/dbraw/zinc/82/69/98/601826998.db2.gz	BCQCWBQWXPEODX-UHFFFAOYSA-N	-2	1	396.808	2.796	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C)cc2C(=O)[O-])ccc1Cl	ZINC000757471143	601828828	/nfs/dbraw/zinc/82/88/28/601828828.db2.gz	DHHGOZLKUOTHSC-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C)c(C(=O)[O-])c2)ccc1Cl	ZINC000757478006	601829985	/nfs/dbraw/zinc/82/99/85/601829985.db2.gz	PJFZWOAUDCRQAA-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CCCNC(=O)c1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1	ZINC000751145013	601836302	/nfs/dbraw/zinc/83/63/02/601836302.db2.gz	HIUDEYJOLPSULH-UHFFFAOYSA-N	-2	1	398.387	2.604	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C(C)C)cc2C(=O)[O-])ccc1[O-]	ZINC000825890848	602198399	/nfs/dbraw/zinc/19/83/99/602198399.db2.gz	YIBHPGVSXBMTQV-UHFFFAOYSA-N	-2	1	392.433	2.973	20	0		GFADML
CCCc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2Br)n[nH]1	ZINC000388324953	602305714	/nfs/dbraw/zinc/30/57/14/602305714.db2.gz	IQZAJRWRNXZADG-UHFFFAOYSA-N	-2	1	388.243	2.624	20	0		GFADML
CC(C)N(CCC[N-]S(=O)(=O)c1sccc1Br)C(=O)[O-]	ZINC000738848986	602389012	/nfs/dbraw/zinc/38/90/12/602389012.db2.gz	UEPKERAGWYOFDU-UHFFFAOYSA-N	-2	1	385.305	2.567	20	0		GFADML
CC(C)c1ccc([C@@H](CNC(=O)c2nc3ccccc3c(=O)[n-]2)NC(=O)[O-])cc1	ZINC000738882607	602391647	/nfs/dbraw/zinc/39/16/47/602391647.db2.gz	MNMJUZWJAMHOPR-QGZVFWFLSA-N	-2	1	394.431	2.785	20	0		GFADML
COc1ccc(NC(=O)[O-])c([N-]S(=O)(=O)c2ccc3c(c2)C[C@H](C)O3)c1	ZINC000739924655	602652517	/nfs/dbraw/zinc/65/25/17/602652517.db2.gz	UBNYTXPZEBNZEN-JTQLQIEISA-N	-2	1	378.406	2.909	20	0		GFADML
CCN(Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)[O-]	ZINC000739442992	602653907	/nfs/dbraw/zinc/65/39/07/602653907.db2.gz	AABDERLQZUMMKM-UHFFFAOYSA-N	-2	1	392.433	2.759	20	0		GFADML
CSc1nc(C)c(CCC(=O)Oc2cccc(CNC(=O)[O-])c2)c(=O)[n-]1	ZINC000740020902	602729672	/nfs/dbraw/zinc/72/96/72/602729672.db2.gz	PZQOTDYNDBMXHQ-UHFFFAOYSA-N	-2	1	377.422	2.518	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])cc3)cc21	ZINC000736135014	603192805	/nfs/dbraw/zinc/19/28/05/603192805.db2.gz	ULFVMPRRDICJNT-UHFFFAOYSA-N	-2	1	389.433	2.876	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC([C@@H]2CCCN2C(=O)[O-])CC1	ZINC000830704751	603481143	/nfs/dbraw/zinc/48/11/43/603481143.db2.gz	RASQLITXQVYEAJ-AWEZNQCLSA-N	-2	1	390.484	2.783	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc2c1CCN2C(=O)[O-]	ZINC000830234556	604014626	/nfs/dbraw/zinc/01/46/26/604014626.db2.gz	UAZZJOGDXCICFZ-UHFFFAOYSA-N	-3	1	376.390	2.535	20	0		GFADML
CC(C)(C)[C@@H](NC(=O)c1cc(NC(=O)OCC(F)(F)F)ccc1[O-])C(=O)[O-]	ZINC000833422265	604710502	/nfs/dbraw/zinc/71/05/02/604710502.db2.gz	BWEITXNPODHZLM-NSHDSACASA-N	-2	1	392.330	2.732	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCSC[C@@H]2CC(=O)[O-])c([O-])c1	ZINC000833442917	604714975	/nfs/dbraw/zinc/71/49/75/604714975.db2.gz	MNBBGDQQEDDCBW-LBPRGKRZSA-N	-2	1	396.465	2.772	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(C)c(Cl)c(C(=O)[O-])c2)c(C(=O)[O-])c1	ZINC000758163042	604743893	/nfs/dbraw/zinc/74/38/93/604743893.db2.gz	KUKWYBRKUJEGCH-UHFFFAOYSA-N	-3	1	399.808	2.854	20	0		GFADML
Cc1cc(F)cc(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(Cl)c1	ZINC000833744972	604991396	/nfs/dbraw/zinc/99/13/96/604991396.db2.gz	NNAPGAFXXGOMHH-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CC(C)c1nc(C2([N-]S(=O)(=O)c3cc(F)ccc3C(=O)[O-])CCCC2)no1	ZINC000833511959	605043168	/nfs/dbraw/zinc/04/31/68/605043168.db2.gz	GJHCPGQJPVBWDY-UHFFFAOYSA-N	-2	1	397.428	2.778	20	0		GFADML
CC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cccc3c2ccnc3C(=O)[O-])cc1	ZINC000833388370	605151445	/nfs/dbraw/zinc/15/14/45/605151445.db2.gz	OLPLPFOJSODLEJ-UHFFFAOYSA-N	-2	1	399.428	2.717	20	0		GFADML
COCCCCSc1nc(-c2ccc(OC)cc2)c(-c2nnn[n-]2)c(=O)[n-]1	ZINC000821687326	607228924	/nfs/dbraw/zinc/22/89/24/607228924.db2.gz	ZBGXXTANIUCBBI-UHFFFAOYSA-N	-2	1	388.453	2.557	20	0		GFADML
Cc1c(Cl)cccc1[N-]S(=O)(=O)c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000057115684	654800649	/nfs/dbraw/zinc/80/06/49/654800649.db2.gz	ALGRJHXDTILHES-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
O=C(NCc1ccco1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000097254603	655033871	/nfs/dbraw/zinc/03/38/71/655033871.db2.gz	ZWXFNOHSKNBDOF-UHFFFAOYSA-N	-2	1	378.431	2.778	20	0		GFADML
Cc1nn(C)c(C)c1[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000275026333	655212126	/nfs/dbraw/zinc/21/21/26/655212126.db2.gz	DYTDBYBRCJDXMN-SNVBAGLBSA-N	-2	1	398.293	2.509	20	0		GFADML
Cc1ccc(Cl)c(S(=O)(=O)[N-][C@H](CC(F)(F)F)C(=O)[O-])c1Cl	ZINC000275233682	655224399	/nfs/dbraw/zinc/22/43/99/655224399.db2.gz	JMHOVXLSEQLXNV-SSDOTTSWSA-N	-2	1	380.171	2.986	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]Nc2c(F)cccc2Cl)c1	ZINC000185341149	655363645	/nfs/dbraw/zinc/36/36/45/655363645.db2.gz	BGBPPRISIFDHHF-UHFFFAOYSA-N	-2	1	380.731	2.761	20	0		GFADML
CC(C)(C)[S@](=O)Cc1cccc([N-]S(=O)(=O)c2c[nH]c(C(=O)[O-])c2)c1	ZINC000265285597	655480457	/nfs/dbraw/zinc/48/04/57/655480457.db2.gz	QBTDWHHIGHCTSY-XMMPIXPASA-N	-2	1	384.479	2.561	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3oc(=O)ccc3c2)cc1Cl	ZINC000743253407	655727339	/nfs/dbraw/zinc/72/73/39/655727339.db2.gz	CVXMHTYGAWXUFS-UHFFFAOYSA-N	-2	1	379.777	2.945	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2cc(F)cc(C(=O)[O-])c2F)cnc1Cl	ZINC000776560412	656757306	/nfs/dbraw/zinc/75/73/06/656757306.db2.gz	JYNKOQKNVKOXAN-UHFFFAOYSA-N	-2	1	378.740	2.521	20	0		GFADML
O=C([O-])c1c(F)cc(C[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)cc1F	ZINC000793985128	658469587	/nfs/dbraw/zinc/46/95/87/658469587.db2.gz	DERWUBZJKGYLCX-UHFFFAOYSA-N	-2	1	397.186	2.843	20	0		GFADML
Cn1ncc([N-]S(=O)(=O)c2c([O-])cccc2OC(F)(F)F)c1C(F)F	ZINC000901905890	663750491	/nfs/dbraw/zinc/75/04/91/663750491.db2.gz	AYLRRXREBXQMFQ-UHFFFAOYSA-N	-2	1	387.286	2.763	20	0		GFADML
O=C([O-])[C@H](C[C@H]1CCCO1)[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000906002479	663907679	/nfs/dbraw/zinc/90/76/79/663907679.db2.gz	YMZWEHWAPBLGEU-KOLCDFICSA-N	-2	1	389.882	2.855	20	0		GFADML
O=S(=O)([N-]c1cccc(OCCn2cncn2)c1)c1cccc(Cl)c1[O-]	ZINC000436476946	450599348	/nfs/dbraw/zinc/59/93/48/450599348.db2.gz	KLORTCGOYVUIJR-UHFFFAOYSA-N	-2	1	394.840	2.517	20	0		GFADML
CS(=O)(=O)[N-]c1cc(F)ccc1NC(=O)c1cc(F)c(F)c([O-])c1F	ZINC000183953533	552324149	/nfs/dbraw/zinc/32/41/49/552324149.db2.gz	IMTQLLZRQHBWQQ-UHFFFAOYSA-N	-2	1	378.303	2.572	20	0		GFADML
CCCC[C@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1C(=O)OC)C(=O)[O-]	ZINC000263462021	553187971	/nfs/dbraw/zinc/18/79/71/553187971.db2.gz	DXVPXSFCFMCXOO-NSHDSACASA-N	-2	1	398.264	2.702	20	0		GFADML
CCc1nnc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2Cl)s1	ZINC000290643386	563716999	/nfs/dbraw/zinc/71/69/99/563716999.db2.gz	MEKMFDITJVPGIE-UHFFFAOYSA-N	-2	1	396.277	2.584	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)[O-])ccc1[O-]	ZINC000563916424	564212526	/nfs/dbraw/zinc/21/25/26/564212526.db2.gz	QFYABFQRRCUTPC-UHFFFAOYSA-N	-2	1	384.797	2.503	20	0		GFADML
C[C@H](CCC[C@H](C)C(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000547609070	564501906	/nfs/dbraw/zinc/50/19/06/564501906.db2.gz	MPUZBGFPUAQHJS-VHSXEESVSA-N	-2	1	378.834	2.806	20	0		GFADML
O=C([O-])[C@@H](CC(F)F)[N-]S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1	ZINC000547878524	564514943	/nfs/dbraw/zinc/51/49/43/564514943.db2.gz	PSYPAFHIKGYSFX-SECBINFHSA-N	-2	1	396.824	2.850	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(F)cc(F)cc1F)c1cccc(Cl)c1	ZINC000547908537	564519751	/nfs/dbraw/zinc/51/97/51/564519751.db2.gz	AGJHMOBDTPVOKN-LBPRGKRZSA-N	-2	1	379.743	2.862	20	0		GFADML
CC(C)=CCSC[C@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)C(=O)[O-]	ZINC000547932264	564522976	/nfs/dbraw/zinc/52/29/76/564522976.db2.gz	ATWAESHFJZPCEG-LBPRGKRZSA-N	-2	1	381.878	2.910	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])cc1Cl	ZINC000481979644	564530612	/nfs/dbraw/zinc/53/06/12/564530612.db2.gz	KYQKFIYCCBBFOG-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)cc2C(=O)[O-])cc1Cl	ZINC000484501332	564589624	/nfs/dbraw/zinc/58/96/24/564589624.db2.gz	LYWUSAOYEFHLAE-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-][C@H](C)CCCCC(=O)[O-])c1F	ZINC000594570373	565399377	/nfs/dbraw/zinc/39/93/77/565399377.db2.gz	SAOPWBSCIOGHQG-SECBINFHSA-N	-2	1	395.836	2.578	20	0		GFADML
CC(=O)N[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2F)s1	ZINC000674049951	565858021	/nfs/dbraw/zinc/85/80/21/565858021.db2.gz	COHHAULDKJRTNW-MRVPVSSYSA-N	-2	1	386.426	2.583	20	0		GFADML
O=C([O-])CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1	ZINC000680998815	566090721	/nfs/dbraw/zinc/09/07/21/566090721.db2.gz	KBSUDCPQQBBRAB-UHFFFAOYSA-N	-2	1	382.825	2.944	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H]2CCCCCC[C@@H]2C(=O)[O-])c(F)c1	ZINC000681580499	566114451	/nfs/dbraw/zinc/11/44/51/566114451.db2.gz	WGMSJEBEXPTYIX-FZMZJTMJSA-N	-2	1	377.409	2.675	20	0		GFADML
O=C([O-])CCCNC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-]	ZINC000821525822	598146036	/nfs/dbraw/zinc/14/60/36/598146036.db2.gz	RPFYJTBVTGDLHI-UHFFFAOYSA-N	-2	1	378.331	2.517	20	0		GFADML
CC(C)(C)c1cc([N-]S(=O)(=O)c2cccc(Cl)c2-c2nnn[n-]2)on1	ZINC000735648677	599322787	/nfs/dbraw/zinc/32/27/87/599322787.db2.gz	WAKJLHMEUNGDNI-UHFFFAOYSA-N	-2	1	382.833	2.606	20	0		GFADML
CC(C)(C)c1cc([N-]S(=O)(=O)c2cccc(Cl)c2-c2nn[n-]n2)on1	ZINC000735648677	599322789	/nfs/dbraw/zinc/32/27/89/599322789.db2.gz	WAKJLHMEUNGDNI-UHFFFAOYSA-N	-2	1	382.833	2.606	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)Nc3ccc4scnc4c3)cc2)[n-]1	ZINC000739878133	599703939	/nfs/dbraw/zinc/70/39/39/599703939.db2.gz	YNMVEGVJPHOEBQ-UHFFFAOYSA-N	-2	1	394.412	2.655	20	0		GFADML
O=C([O-])CCCCNC(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1[O-]	ZINC000739667591	599741597	/nfs/dbraw/zinc/74/15/97/599741597.db2.gz	KVGDZWDEYXVMCT-QGZVFWFLSA-N	-2	1	384.432	2.521	20	0		GFADML
Cc1ccc(C(=O)N(C)C)cc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000477408892	599906471	/nfs/dbraw/zinc/90/64/71/599906471.db2.gz	ZBMAFFLEJCILIX-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)N[C@H](CCC(=O)[O-])c1ccccc1	ZINC000738873896	599952647	/nfs/dbraw/zinc/95/26/47/599952647.db2.gz	FILGZNJIOHNPBA-QGZVFWFLSA-N	-2	1	396.447	2.707	20	0		GFADML
O=C([O-])Nc1cc([N-]S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)ccc1F	ZINC000740013427	600101733	/nfs/dbraw/zinc/10/17/33/600101733.db2.gz	TWBQRRCYJMSAAL-UHFFFAOYSA-N	-2	1	393.396	2.991	20	0		GFADML
COC(=O)c1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2F)c1	ZINC000327485390	600169692	/nfs/dbraw/zinc/16/96/92/600169692.db2.gz	CRLDIPCGEIWUNB-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CN(Cc1ccc([N-]S(=O)(=O)c2ccc(CCC(=O)[O-])cc2)cc1)C(=O)[O-]	ZINC000737486213	600299171	/nfs/dbraw/zinc/29/91/71/600299171.db2.gz	RQMNAIYKKIGHSH-UHFFFAOYSA-N	-3	1	392.433	2.614	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(-c3cn4cccnc4n3)cc2)cc1	ZINC000740177140	600424907	/nfs/dbraw/zinc/42/49/07/600424907.db2.gz	GKNFHSWZZPEINV-UHFFFAOYSA-N	-2	1	394.412	2.895	20	0		GFADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000060554406	600481950	/nfs/dbraw/zinc/48/19/50/600481950.db2.gz	OVIAJSVDFOIWLH-UHFFFAOYSA-N	-3	1	383.809	2.856	20	0		GFADML
O=C([O-])c1ccc(Br)c(S(=O)(=O)[N-]c2ccc3nccn3c2)c1	ZINC000738678320	600513156	/nfs/dbraw/zinc/51/31/56/600513156.db2.gz	HMQYAZGBXGMCGF-UHFFFAOYSA-N	-2	1	396.222	2.596	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(C)c(OC)c(C)c2)cc1C(=O)[O-]	ZINC000831434910	600689478	/nfs/dbraw/zinc/68/94/78/600689478.db2.gz	KGQMPNNZQLZNSG-UHFFFAOYSA-N	-2	1	393.417	2.598	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)ccc1NC(C)=O	ZINC000737899407	600889645	/nfs/dbraw/zinc/88/96/45/600889645.db2.gz	MBCNSWAHNFVCQU-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)cc1C	ZINC000737703341	600894873	/nfs/dbraw/zinc/89/48/73/600894873.db2.gz	VQVCOPBQXOZQRO-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3ccc(C=CC(=O)[O-])cc3)c2)n[nH]1	ZINC000832990496	601205858	/nfs/dbraw/zinc/20/58/58/601205858.db2.gz	DBMZRJSATZNLCJ-UXBLZVDNSA-N	-2	1	398.444	2.987	20	0		GFADML
CC(C)c1nc(C2([N-]S(=O)(=O)c3cc(C(=O)[O-])ccc3F)CCCC2)no1	ZINC000827144064	601227642	/nfs/dbraw/zinc/22/76/42/601227642.db2.gz	AFYYYTUJEGDADZ-UHFFFAOYSA-N	-2	1	397.428	2.778	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2C)c1	ZINC000547560131	601318265	/nfs/dbraw/zinc/31/82/65/601318265.db2.gz	WRPDPXKHKFJMTH-UHFFFAOYSA-N	-2	1	377.418	2.897	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)ccc1F	ZINC000825890868	601320334	/nfs/dbraw/zinc/32/03/34/601320334.db2.gz	ZPDCAXJJTCBVLV-RUDMXATFSA-N	-2	1	378.381	2.683	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(OC[C@H]3CCCO3)c2)ccc1F	ZINC000044857833	601321378	/nfs/dbraw/zinc/32/13/78/601321378.db2.gz	IJOKVQZZFXBZHM-CQSZACIVSA-N	-2	1	395.408	2.883	20	0		GFADML
COC(=O)/C=C/c1ccc(S(=O)(=O)[N-]c2ccc(N(C)C(=O)[O-])cc2)cc1	ZINC000831124786	601326147	/nfs/dbraw/zinc/32/61/47/601326147.db2.gz	UNVGCTKZHJZRRI-LFYBBSHMSA-N	-2	1	390.417	2.788	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)ccc1F	ZINC000831348446	601328832	/nfs/dbraw/zinc/32/88/32/601328832.db2.gz	NXTCULADIGJQQM-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(N3CCCC3)nc2)c1C	ZINC000013249875	601359264	/nfs/dbraw/zinc/35/92/64/601359264.db2.gz	RPZUIXRFXWAHQC-UHFFFAOYSA-N	-2	1	375.450	2.798	20	0		GFADML
Cn1ccnc1-c1cccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000738406897	601359807	/nfs/dbraw/zinc/35/98/07/601359807.db2.gz	IZUBJLKKNLFQPB-UHFFFAOYSA-N	-2	1	375.381	2.725	20	0		GFADML
Cn1ccnc1-c1cccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000833059631	601360389	/nfs/dbraw/zinc/36/03/89/601360389.db2.gz	XMRXGAVBABCQST-JXMROGBWSA-N	-2	1	383.429	2.986	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1csc(C(=O)[O-])c1)c1nc(C2CCCCC2)no1	ZINC000827767758	601384925	/nfs/dbraw/zinc/38/49/25/601384925.db2.gz	KAGPNFRDWXUXNN-VIFPVBQESA-N	-2	1	385.467	2.917	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(F)cc(F)cc1F)c1ccc(Cl)cc1	ZINC000833169511	601388929	/nfs/dbraw/zinc/38/89/29/601388929.db2.gz	PXURRVIOTQXMEU-LBPRGKRZSA-N	-2	1	379.743	2.862	20	0		GFADML
CCCCc1nc2ccc([N-]S(=O)(=O)c3csnc3C(=O)[O-])cc2[nH]1	ZINC000829441663	601486160	/nfs/dbraw/zinc/48/61/60/601486160.db2.gz	WPGJOGOJRIQQLA-UHFFFAOYSA-N	-2	1	380.451	2.861	20	0		GFADML
CC[C@H](NC(=O)c1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)cc1)C(=O)[O-]	ZINC000647259356	601749520	/nfs/dbraw/zinc/74/95/20/601749520.db2.gz	FTTPYXFETKCRNM-INIZCTEOSA-N	-2	1	390.461	2.697	20	0		GFADML
CC[C@@H](NC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(C)cc2)c1)C(=O)[O-]	ZINC000485863902	601751048	/nfs/dbraw/zinc/75/10/48/601751048.db2.gz	NPTOVYCKZTZSTP-MRXNPFEDSA-N	-2	1	390.461	2.697	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1C	ZINC000028249019	601826358	/nfs/dbraw/zinc/82/63/58/601826358.db2.gz	VADPTBDCKUHTJN-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)c(C(=O)[O-])c1	ZINC000063877901	601837319	/nfs/dbraw/zinc/83/73/19/601837319.db2.gz	WOBNFLBNHXFYHS-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(NC(=O)NC2CC2)cc1	ZINC000833157272	601856863	/nfs/dbraw/zinc/85/68/63/601856863.db2.gz	VKAPIDVELPVPEY-UHFFFAOYSA-N	-2	1	393.396	2.609	20	0		GFADML
CCC[C@H](C)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C(=O)OC)[nH]n1	ZINC000829215331	601861932	/nfs/dbraw/zinc/86/19/32/601861932.db2.gz	AKMBBHBKHIQLLJ-JTQLQIEISA-N	-2	1	395.437	2.599	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2cc(C3CCCCC3)n[nH]2)cc1	ZINC000833259501	602308610	/nfs/dbraw/zinc/30/86/10/602308610.db2.gz	RSVWNXUOWSYYOF-UHFFFAOYSA-N	-2	1	379.438	2.722	20	0		GFADML
CCN(CC)C(=O)c1ccc(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])cc1	ZINC000739408214	602849242	/nfs/dbraw/zinc/84/92/42/602849242.db2.gz	VIKOGQULKGSEDN-UHFFFAOYSA-N	-2	1	385.420	2.894	20	0		GFADML
COCC[S@@](=O)Cc1cccc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])c1	ZINC000739837661	602867480	/nfs/dbraw/zinc/86/74/80/602867480.db2.gz	OMIRXFFNFVIGST-HHHXNRCGSA-N	-2	1	392.433	2.630	20	0		GFADML
CC(C)(CC(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1)NC(=O)[O-]	ZINC000738737155	603021630	/nfs/dbraw/zinc/02/16/30/603021630.db2.gz	DIPDXYBBXNSOCS-UHFFFAOYSA-N	-2	1	391.449	2.862	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)Oc1ccc(N(C)C(=O)[O-])cc1	ZINC000827480002	603051637	/nfs/dbraw/zinc/05/16/37/603051637.db2.gz	AUSHBAIZZWZMCT-UHFFFAOYSA-N	-2	1	378.406	2.782	20	0		GFADML
CCOC(=O)c1cccc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)c1	ZINC000827350357	603403323	/nfs/dbraw/zinc/40/33/23/603403323.db2.gz	TXRYRMQSAIROKH-LBPRGKRZSA-N	-2	1	392.433	2.993	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])ccc1C	ZINC000828761482	603528152	/nfs/dbraw/zinc/52/81/52/603528152.db2.gz	WBLUMBDWIRENNF-UHFFFAOYSA-N	-2	1	390.417	2.623	20	0		GFADML
O=C([O-])NC[C@H](C(=O)OCc1cc(=O)oc2cc([O-])ccc12)c1ccccc1	ZINC000832414285	603925978	/nfs/dbraw/zinc/92/59/78/603925978.db2.gz	IEIBWWAIHNILKQ-INIZCTEOSA-N	-2	1	383.356	2.593	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1cccc2c1CCN2C(=O)[O-]	ZINC000827481725	603941339	/nfs/dbraw/zinc/94/13/39/603941339.db2.gz	XSTKFCFOTDUESV-UHFFFAOYSA-N	-2	1	389.433	2.741	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])ccc1C	ZINC000828761424	604014771	/nfs/dbraw/zinc/01/47/71/604014771.db2.gz	UBZHYDGZYCNICF-UHFFFAOYSA-N	-2	1	390.417	2.623	20	0		GFADML
CCc1cc2c(COC(=O)[C@H]3CC[C@H](NC(=O)[O-])C3)cc(=O)oc2cc1[O-]	ZINC000827571122	604055978	/nfs/dbraw/zinc/05/59/78/604055978.db2.gz	XHWMELRNWZLJSE-AAEUAGOBSA-N	-2	1	375.377	2.541	20	0		GFADML
O=C([O-])Cc1ccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)cc1	ZINC000762442905	604631932	/nfs/dbraw/zinc/63/19/32/604631932.db2.gz	HNCVYDGBZWYEKX-UHFFFAOYSA-N	-3	1	387.772	2.605	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(F)cc2C(=O)[O-])ccc1Cl	ZINC000833398465	604744734	/nfs/dbraw/zinc/74/47/34/604744734.db2.gz	JRXOFXCSXDNLLG-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(N(C)C)cc2C)c(OC)c1C(=O)[O-]	ZINC000833734501	604861872	/nfs/dbraw/zinc/86/18/72/604861872.db2.gz	INYHBKFIGURIIE-UHFFFAOYSA-N	-2	1	394.449	2.577	20	0		GFADML
COc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)c(C(=O)[O-])c1	ZINC000758162867	604953282	/nfs/dbraw/zinc/95/32/82/604953282.db2.gz	HICUNNLVBGJLHT-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
CC(C)COC[C@@H]([N-]S(=O)(=O)c1cc(F)ccc1C(=O)[O-])c1ccco1	ZINC000833487781	605023617	/nfs/dbraw/zinc/02/36/17/605023617.db2.gz	HNNMOGNAUJVAAM-CQSZACIVSA-N	-2	1	385.413	2.809	20	0		GFADML
CC(=O)N(C)c1cccc([N-]S(=O)(=O)c2ccc(C3(C(=O)[O-])CC3)cc2)c1	ZINC000833389586	605123995	/nfs/dbraw/zinc/12/39/95/605123995.db2.gz	QJOLZPPPQDOHIS-UHFFFAOYSA-N	-2	1	388.445	2.586	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc3[nH]nc(C(=O)[O-])c3c2)c(C)c1F	ZINC000833734418	605263604	/nfs/dbraw/zinc/26/36/04/605263604.db2.gz	CVNAITQYNGQKEP-UHFFFAOYSA-N	-2	1	379.369	2.518	20	0		GFADML
O=C([O-])Nc1ccc([N-]S(=O)(=O)c2ccc(OCC(F)(F)F)nc2)cc1	ZINC000834262823	605390996	/nfs/dbraw/zinc/39/09/96/605390996.db2.gz	VFUMJDBFGBILLF-UHFFFAOYSA-N	-2	1	391.327	2.913	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)OCc1cccc(NC(=O)[O-])c1	ZINC000830785640	605545904	/nfs/dbraw/zinc/54/59/04/605545904.db2.gz	PVGJZWDPPKQBHJ-UHFFFAOYSA-N	-2	1	384.392	2.818	20	0		GFADML
COc1cc(O)cc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2C(=O)[O-])c1	ZINC000833729450	605599595	/nfs/dbraw/zinc/59/95/95/605599595.db2.gz	SGPMKBCZCMICKB-UHFFFAOYSA-N	-2	1	391.323	2.919	20	0		GFADML
Cn1ccnc1[C@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1cccc(F)c1	ZINC000833956170	605627578	/nfs/dbraw/zinc/62/75/78/605627578.db2.gz	XNYUVSMPTGAWDS-MRXNPFEDSA-N	-2	1	384.367	2.874	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1sccc1Br)C1CCCCC1	ZINC000049060850	654714508	/nfs/dbraw/zinc/71/45/08/654714508.db2.gz	FQJSCJHSRYSVIQ-JTQLQIEISA-N	-2	1	382.301	2.822	20	0		GFADML
O=C([O-])[C@@H]1C=C[C@@H]([N-]S(=O)(=O)c2c(Cl)cc(F)cc2Br)C1	ZINC000275040053	655213262	/nfs/dbraw/zinc/21/32/62/655213262.db2.gz	QYSVJSFNEKBBHR-HTRCEHHLSA-N	-2	1	398.637	2.549	20	0		GFADML
CCC[C@H]([N-]S(=O)(=O)c1csnc1C(=O)[O-])c1ccc(F)cc1F	ZINC000577369467	655457859	/nfs/dbraw/zinc/45/78/59/655457859.db2.gz	DQYMGCJLUVXMGY-NSHDSACASA-N	-2	1	376.406	2.939	20	0		GFADML
CN(C)C(=O)Sc1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)c1	ZINC000728508020	655556023	/nfs/dbraw/zinc/55/60/23/655556023.db2.gz	NAJKDBOAQMRVDB-UHFFFAOYSA-N	-2	1	380.447	2.959	20	0		GFADML
COc1c(F)cc([N-]S(=O)(=O)c2cc(C)c(F)c(C(=O)[O-])c2)cc1F	ZINC000763284281	656078242	/nfs/dbraw/zinc/07/82/42/656078242.db2.gz	NJMITJYBINTVQB-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
C[C@H](CC(C)(C)[N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000777912372	656841741	/nfs/dbraw/zinc/84/17/41/656841741.db2.gz	RZQXRLTZOFLJJM-SSDOTTSWSA-N	-2	1	399.694	2.665	20	0		GFADML
O=C([O-])/C=C/C[N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl	ZINC000788448232	657720305	/nfs/dbraw/zinc/72/03/05/657720305.db2.gz	QUQIVJNZDVKUCV-OWOJBTEDSA-N	-2	1	389.054	2.675	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2cc(Br)cnc2Cl)CCCCC1	ZINC000917842023	664490692	/nfs/dbraw/zinc/49/06/92/664490692.db2.gz	CMYWIGGITAGZLE-UHFFFAOYSA-N	-2	1	397.678	2.563	20	0		GFADML
O=C([O-])c1cc(Br)c(S(=O)(=O)[N-]CCCC(F)(F)F)s1	ZINC000282319098	563406346	/nfs/dbraw/zinc/40/63/46/563406346.db2.gz	VVVMAISKHUPVOK-UHFFFAOYSA-N	-2	1	396.206	2.830	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)c(C(=O)[O-])c1	ZINC000327288925	563457499	/nfs/dbraw/zinc/45/74/99/563457499.db2.gz	JHAJTJSRGNXAPR-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
CS[C@@H](C)CNC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436499961	563672915	/nfs/dbraw/zinc/67/29/15/563672915.db2.gz	YHZPDEUHRKVWAQ-JTQLQIEISA-N	-2	1	386.520	2.736	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCC[C@@H](F)C1	ZINC000563328832	564186490	/nfs/dbraw/zinc/18/64/90/564186490.db2.gz	AIOJVPYZRSYUNU-LLVKDONJSA-N	-2	1	384.454	2.829	20	0		GFADML
Cn1cc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2[O-])c(C(F)(F)F)n1	ZINC000451044710	564267157	/nfs/dbraw/zinc/26/71/57/564267157.db2.gz	ZOSDZCNRTCURNO-UHFFFAOYSA-N	-2	1	389.277	2.964	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2C)c1	ZINC000476267811	564332068	/nfs/dbraw/zinc/33/20/68/564332068.db2.gz	ZRUFGIJDZJISRN-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C(NC1(CF)CCC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000514606336	564450327	/nfs/dbraw/zinc/45/03/27/564450327.db2.gz	YNUDQJYHPLFHAK-UHFFFAOYSA-N	-2	1	384.454	2.877	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cc(F)ccc1F)Cc1ccccc1Cl	ZINC000547556739	564494040	/nfs/dbraw/zinc/49/40/40/564494040.db2.gz	DEOUXXOTINALPK-NSHDSACASA-N	-2	1	389.807	2.840	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC[C@@H]1C1CC1	ZINC000517072682	564523733	/nfs/dbraw/zinc/52/37/33/564523733.db2.gz	DIHJYHUZZGCSCX-CQSZACIVSA-N	-2	1	378.475	2.879	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])ccc1F	ZINC000523125350	564661930	/nfs/dbraw/zinc/66/19/30/564661930.db2.gz	RAIHBJXIQMTTHG-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
Cc1csc(C(=O)[O-])c1S(=O)(=O)[N-]C1(c2noc(C)n2)CCCCC1	ZINC000574397374	564671420	/nfs/dbraw/zinc/67/14/20/564671420.db2.gz	RFNRALNTIOZAGL-UHFFFAOYSA-N	-2	1	385.467	2.584	20	0		GFADML
O=C([O-])CC[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000582650343	564856620	/nfs/dbraw/zinc/85/66/20/564856620.db2.gz	OKDLTIVAKUNBOJ-VHSXEESVSA-N	-2	1	380.260	2.744	20	0		GFADML
CSc1ccc(S(=O)(=O)[N-]c2cc3c(cc2C(=O)[O-])OCCO3)cc1	ZINC000622553581	565471897	/nfs/dbraw/zinc/47/18/97/565471897.db2.gz	YWMIDNZXDSBVAP-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
COC1(C[C@@H]([N-]S(=O)(=O)c2cc(Cl)sc2Cl)C(=O)[O-])CCC1	ZINC000650431903	565821709	/nfs/dbraw/zinc/82/17/09/565821709.db2.gz	GYVWNBBKBSIQPE-SSDOTTSWSA-N	-2	1	388.294	2.746	20	0		GFADML
COc1ccccc1C[C@@H](C[N-]S(=O)(=O)c1sccc1Cl)C(=O)[O-]	ZINC000654770172	566022042	/nfs/dbraw/zinc/02/20/42/566022042.db2.gz	LBNQQNMPBSUQGK-NSHDSACASA-N	-2	1	389.882	2.632	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2ccsc2)c(F)c1	ZINC000681558584	566112131	/nfs/dbraw/zinc/11/21/31/566112131.db2.gz	RVMATALBNXISMU-LBPRGKRZSA-N	-2	1	377.390	2.529	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2cccc(NC(=O)[O-])c2)c(C)c1OCC(=O)[O-]	ZINC000738655419	599769321	/nfs/dbraw/zinc/76/93/21/599769321.db2.gz	TYUZDOAHXMBUDC-UHFFFAOYSA-N	-3	1	394.405	2.658	20	0		GFADML
O=C([O-])c1ccccc1S(=O)(=O)[N-]c1cccc(C(=O)Nc2ccccn2)c1	ZINC000739487432	599927392	/nfs/dbraw/zinc/92/73/92/599927392.db2.gz	KJKBFTNCSMBZGH-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
CO[C@H](C)c1cccc(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000737732006	599992182	/nfs/dbraw/zinc/99/21/82/599992182.db2.gz	ALWBHAGCUGGWJK-CYBMUJFWSA-N	-2	1	395.415	2.752	20	0		GFADML
COC(=O)c1ccc(C(=O)[O-])c(S(=O)(=O)[N-]c2cccc(CSC)c2)c1	ZINC000737680757	600053090	/nfs/dbraw/zinc/05/30/90/600053090.db2.gz	HKNPAAGBTWGUNP-UHFFFAOYSA-N	-2	1	395.458	2.835	20	0		GFADML
O=Cc1ccc(OC(F)(F)C(=O)[N-][C@@H](C(=O)[O-])c2cc(F)ccc2F)cc1	ZINC000740317169	600068078	/nfs/dbraw/zinc/06/80/78/600068078.db2.gz	DYTWRZIKUAOMRO-CQSZACIVSA-N	-2	1	385.269	2.691	20	0		GFADML
Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc1)CC2	ZINC000738671136	600075459	/nfs/dbraw/zinc/07/54/59/600075459.db2.gz	SORPTTFYZNLSCW-IBGZPJMESA-N	-2	1	391.427	2.518	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]C[C@@H](Cc2cccc(C)c2)C(=O)[O-])c(F)c1	ZINC000681580000	600096854	/nfs/dbraw/zinc/09/68/54/600096854.db2.gz	CTZYEHKFVMKDDF-CYBMUJFWSA-N	-2	1	399.415	2.504	20	0		GFADML
CC(=O)N1CCCc2cc([N-]S(=O)(=O)c3cc(F)ccc3C(=O)[O-])ccc21	ZINC000736136663	600096928	/nfs/dbraw/zinc/09/69/28/600096928.db2.gz	ZUHFCGWCQXPYSB-UHFFFAOYSA-N	-2	1	392.408	2.624	20	0		GFADML
COc1ccc(-c2cc3[n-]c(CN4CCC[C@@H](C(=O)[O-])C4)nc(=O)c3s2)cc1	ZINC000737910353	600101159	/nfs/dbraw/zinc/10/11/59/600101159.db2.gz	ZXIKDRKFIXIWAV-CYBMUJFWSA-N	-2	1	399.472	2.957	20	0		GFADML
Cc1cccc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)c(F)c2)c1C(=O)[O-]	ZINC000738743977	600458810	/nfs/dbraw/zinc/45/88/10/600458810.db2.gz	HFUZBGSKOYLBLM-UHFFFAOYSA-N	-2	1	392.408	2.760	20	0		GFADML
CC(C)(C)[C@@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1)C(=O)[O-]	ZINC000675985333	600528563	/nfs/dbraw/zinc/52/85/63/600528563.db2.gz	OUSACGGAFNHTHL-INIZCTEOSA-N	-2	1	390.461	2.717	20	0		GFADML
O=C([O-])CCCc1nnc([N-]C(=O)c2csc(Nc3ccccn3)n2)s1	ZINC000739711698	600555182	/nfs/dbraw/zinc/55/51/82/600555182.db2.gz	OFJKXQWLXXAOEK-UHFFFAOYSA-N	-2	1	390.450	2.793	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc1C(=O)[O-]	ZINC000737210080	600636581	/nfs/dbraw/zinc/63/65/81/600636581.db2.gz	IRFQNCVGIAQYDI-UHFFFAOYSA-N	-3	1	399.808	2.936	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2c3nsnc3ccc2Cl)cs1	ZINC000315811605	600686364	/nfs/dbraw/zinc/68/63/64/600686364.db2.gz	XQDSLPCNTYAULG-UHFFFAOYSA-N	-2	1	375.840	2.905	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(N2CCOC2=O)c1C	ZINC000743267554	600691215	/nfs/dbraw/zinc/69/12/15/600691215.db2.gz	DZKZNSMTBGCGID-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])n(C)c2)cc1NC(=O)C(C)(C)C	ZINC000264687466	600815276	/nfs/dbraw/zinc/81/52/76/600815276.db2.gz	BLWGURAPGQXGGB-UHFFFAOYSA-N	-2	1	393.465	2.817	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])cc1N1CCOC1=O	ZINC000832950681	600868256	/nfs/dbraw/zinc/86/82/56/600868256.db2.gz	UJMPZSCWWSOFKR-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)N(C)C)c2)ccc1C(=O)[O-]	ZINC000506735844	600888817	/nfs/dbraw/zinc/88/88/17/600888817.db2.gz	NZUJVJFSGVATBL-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc3oc(=O)ccc3c2)c1	ZINC000740076279	600891303	/nfs/dbraw/zinc/89/13/03/600891303.db2.gz	UYIWVRFBNXSXFZ-UHFFFAOYSA-N	-2	1	379.777	2.945	20	0		GFADML
C[S@](=O)Cc1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000738179695	600894986	/nfs/dbraw/zinc/89/49/86/600894986.db2.gz	MDPULZPUEWVTHD-QHCPKHFHSA-N	-2	1	387.866	2.718	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1	ZINC000736233350	600899602	/nfs/dbraw/zinc/89/96/02/600899602.db2.gz	YIXZHPRCRBDSDQ-UHFFFAOYSA-N	-2	1	387.413	2.956	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccc([S@@](=O)C(F)(F)F)cc2)c1	ZINC000748676228	601127085	/nfs/dbraw/zinc/12/70/85/601127085.db2.gz	YHUBUESRXZJERU-XMMPIXPASA-N	-2	1	393.364	2.813	20	0		GFADML
CC(C)(O)COc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000826636924	601224550	/nfs/dbraw/zinc/22/45/50/601224550.db2.gz	VLLDKNYWUPHMPD-UHFFFAOYSA-N	-2	1	399.852	2.989	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](c2ccccc2)[C@@H](C)C(=O)[O-])c(F)c1	ZINC000681579791	601225206	/nfs/dbraw/zinc/22/52/06/601225206.db2.gz	VRUPFIOXWGERHZ-BMIGLBTASA-N	-2	1	385.388	2.714	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)c1	ZINC000466266311	601234820	/nfs/dbraw/zinc/23/48/20/601234820.db2.gz	KXNRBUYEIAFTRR-UHFFFAOYSA-N	-2	1	379.434	2.909	20	0		GFADML
CC(C)c1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2[O-])c(C(=O)[O-])c1	ZINC000827124837	601249759	/nfs/dbraw/zinc/24/97/59/601249759.db2.gz	RWMCMSKMCYAREW-UHFFFAOYSA-N	-3	1	379.390	2.713	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc(OC)c1OC	ZINC000008105067	601316522	/nfs/dbraw/zinc/31/65/22/601316522.db2.gz	FAEXYKIEGDTAIQ-UHFFFAOYSA-N	-2	1	395.433	2.828	20	0		GFADML
CCS(=O)(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1	ZINC000014097562	601319931	/nfs/dbraw/zinc/31/99/31/601319931.db2.gz	SDHCJXJCHCQHHC-UHFFFAOYSA-N	-2	1	397.474	2.596	20	0		GFADML
CC(C)n1ncc2cc([N-]S(=O)(=O)c3ccc(/C=C/C(=O)[O-])cc3)cnc21	ZINC000032097948	601322151	/nfs/dbraw/zinc/32/21/51/601322151.db2.gz	WLGUUNFTHDGZRD-VMPITWQZSA-N	-2	1	386.433	2.911	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(N3CCCCC3=O)c2)ccc1F	ZINC000024956784	601322196	/nfs/dbraw/zinc/32/21/96/601322196.db2.gz	XJBPQJPEENIAOM-UHFFFAOYSA-N	-2	1	392.408	2.842	20	0		GFADML
CC(=O)Nc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000729964970	601329893	/nfs/dbraw/zinc/32/98/93/601329893.db2.gz	IFLCSYNTKUSIDH-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1Cl	ZINC000735646507	601332363	/nfs/dbraw/zinc/33/23/63/601332363.db2.gz	RRHHSHHEHTVSBP-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)CCC3)cc(F)c1F	ZINC000751142465	601485729	/nfs/dbraw/zinc/48/57/29/601485729.db2.gz	LCAXNXZGVWIYSL-UHFFFAOYSA-N	-2	1	381.356	2.983	20	0		GFADML
Cc1ccccc1-c1cc([N-]S(=O)(=O)c2ccc(Cl)nc2C(=O)[O-])[nH]n1	ZINC000832975059	601486108	/nfs/dbraw/zinc/48/61/08/601486108.db2.gz	XBOLDRVTTKXPNB-UHFFFAOYSA-N	-2	1	392.824	2.933	20	0		GFADML
CC(C)Oc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000754254679	601574887	/nfs/dbraw/zinc/57/48/87/601574887.db2.gz	CKARDYGFLFHWDP-UHFFFAOYSA-N	-2	1	397.380	2.810	20	0		GFADML
CC[C@H](NC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(F)cc2)c1)C(=O)[O-]	ZINC000828971459	601761643	/nfs/dbraw/zinc/76/16/43/601761643.db2.gz	JBHBFUFUDUTSQT-HNNXBMFYSA-N	-2	1	394.424	2.528	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)Nc1nc(CCCC(=O)[O-])cs1	ZINC000832993973	601784219	/nfs/dbraw/zinc/78/42/19/601784219.db2.gz	MQHTZBXSJVIFSW-UHFFFAOYSA-N	-2	1	378.454	2.904	20	0		GFADML
CNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000029323596	601827166	/nfs/dbraw/zinc/82/71/66/601827166.db2.gz	FSTBRMPPXQAHEU-UHFFFAOYSA-N	-2	1	383.813	2.590	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-c3ncon3)cc2)ccc1Cl	ZINC000726931783	601828341	/nfs/dbraw/zinc/82/83/41/601828341.db2.gz	ZSYYFFDXGONATQ-UHFFFAOYSA-N	-2	1	379.781	2.889	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(NC(=O)[O-])c2)cc(F)c1F	ZINC000831348505	601837159	/nfs/dbraw/zinc/83/71/59/601837159.db2.gz	VYSALCNVVXNXFX-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000762618999	601881017	/nfs/dbraw/zinc/88/10/17/601881017.db2.gz	ZQBWSHTXFGTBAL-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CCCc1cc([N-]S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)[nH]n1	ZINC000317662325	602305697	/nfs/dbraw/zinc/30/56/97/602305697.db2.gz	UMEPEAKFLXCQIF-UHFFFAOYSA-N	-2	1	388.243	2.624	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3n[nH]nc3c2)c(Cl)cc1Cl	ZINC000755255472	602318450	/nfs/dbraw/zinc/31/84/50/602318450.db2.gz	DTKKYWPPESNLPV-UHFFFAOYSA-N	-2	1	387.204	2.764	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)Nc1ccc2c(c1)CCCN2C(=O)[O-]	ZINC000740231853	602577064	/nfs/dbraw/zinc/57/70/64/602577064.db2.gz	AUDFOKJKAFNSIC-UHFFFAOYSA-N	-2	1	395.419	2.664	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)CCN2C(=O)[O-]	ZINC000740282861	602645547	/nfs/dbraw/zinc/64/55/47/602645547.db2.gz	ZJEVUBQIBNFFHT-UHFFFAOYSA-N	-3	1	382.419	2.596	20	0		GFADML
COCCc1ccc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)cc1	ZINC000739836650	602655824	/nfs/dbraw/zinc/65/58/24/602655824.db2.gz	HRCODFKJZKIBJY-UHFFFAOYSA-N	-2	1	378.450	2.786	20	0		GFADML
O=C([O-])NCc1nc(C(=O)[N-]c2nnc(Cc3ccccc3F)s2)cs1	ZINC000740685244	602704112	/nfs/dbraw/zinc/70/41/12/602704112.db2.gz	GREWDTCVYLKUGW-UHFFFAOYSA-N	-2	1	393.425	2.744	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)c([O-])c1	ZINC000740697010	602859551	/nfs/dbraw/zinc/85/95/51/602859551.db2.gz	DKVNHISICFZGQW-INIZCTEOSA-N	-2	1	384.310	2.662	20	0		GFADML
CN(C[C@H]1CCN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1)C(=O)[O-]	ZINC000739658096	602860939	/nfs/dbraw/zinc/86/09/39/602860939.db2.gz	WDIFQVJNKCZEEY-GFCCVEGCSA-N	-2	1	393.440	2.811	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)Oc1ccc(NC(=O)[O-])cc1	ZINC000738336275	602965067	/nfs/dbraw/zinc/96/50/67/602965067.db2.gz	GXUWZBQVQQAAHZ-UHFFFAOYSA-N	-2	1	380.360	2.791	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)c1	ZINC000828771819	603400353	/nfs/dbraw/zinc/40/03/53/603400353.db2.gz	GLTPLNPCXQMOJH-GFCCVEGCSA-N	-2	1	392.433	2.911	20	0		GFADML
C[C@H](NC(=O)[O-])c1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2F)cc1	ZINC000825448643	603402429	/nfs/dbraw/zinc/40/24/29/603402429.db2.gz	GGRUQEWJSYIPHD-VIFPVBQESA-N	-2	1	382.369	2.653	20	0		GFADML
Cc1nn(-c2ccccc2C)c2sc(C(=O)Nc3nc(CC(=O)[O-])n[n-]3)cc12	ZINC000832976594	604281742	/nfs/dbraw/zinc/28/17/42/604281742.db2.gz	TYPKRXAMIPQLJB-UHFFFAOYSA-N	-2	1	396.432	2.701	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@@H](C)c1cc(C)c(C(=O)[O-])o1	ZINC000830136816	604573974	/nfs/dbraw/zinc/57/39/74/604573974.db2.gz	JOHVKJFFIHJLGR-NSHDSACASA-N	-2	1	381.406	2.966	20	0		GFADML
O=C([O-])C[C@@H]1CCCN1C(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1	ZINC000262959980	604593514	/nfs/dbraw/zinc/59/35/14/604593514.db2.gz	NSMGPSHHAZUGHS-INIZCTEOSA-N	-2	1	388.445	2.567	20	0		GFADML
O=C([O-])[C@H](c1cccc(Cl)c1)N1CCN(C(=O)c2cc(F)ccc2[O-])CC1	ZINC000833173674	604708721	/nfs/dbraw/zinc/70/87/21/604708721.db2.gz	UWKPPECVFZCBPN-KRWDZBQOSA-N	-2	1	392.814	2.768	20	0		GFADML
CC1(CNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CCCCCC1	ZINC000833564286	605198962	/nfs/dbraw/zinc/19/89/62/605198962.db2.gz	WNDAQPXKZPVECF-UHFFFAOYSA-N	-2	1	385.464	2.883	20	0		GFADML
Cn1ccnc1[C@@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1ccc(F)cc1	ZINC000833956465	605627597	/nfs/dbraw/zinc/62/75/97/605627597.db2.gz	YOJDHHJYSSSXMK-INIZCTEOSA-N	-2	1	384.367	2.874	20	0		GFADML
C[C@@H](CCCC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000274985999	655210222	/nfs/dbraw/zinc/21/02/22/655210222.db2.gz	MBNAUZHWEYRKKD-ZETCQYMHSA-N	-2	1	386.214	2.649	20	0		GFADML
CC(C)(C)c1csc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)n1	ZINC000185005847	655361751	/nfs/dbraw/zinc/36/17/51/655361751.db2.gz	FHVWGJLVUHWFCB-UHFFFAOYSA-N	-2	1	390.433	2.896	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]CCCOC2CCCCC2)c1	ZINC000761242912	656004665	/nfs/dbraw/zinc/00/46/65/656004665.db2.gz	XVYUAFUPADSTRG-UHFFFAOYSA-N	-2	1	377.409	2.681	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccccc1F	ZINC000776444025	656741991	/nfs/dbraw/zinc/74/19/91/656741991.db2.gz	QQJLCPKHTARIQL-SNVBAGLBSA-N	-2	1	379.196	2.632	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccccc1F	ZINC000776444024	656742198	/nfs/dbraw/zinc/74/21/98/656742198.db2.gz	QQJLCPKHTARIQL-JTQLQIEISA-N	-2	1	379.196	2.632	20	0		GFADML
C[C@H](CC[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)C(=O)[O-]	ZINC000788084033	657649218	/nfs/dbraw/zinc/64/92/18/657649218.db2.gz	WNWJDGCLOHABET-ZCFIWIBFSA-N	-2	1	388.642	2.631	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccccc1	ZINC000788455972	657724097	/nfs/dbraw/zinc/72/40/97/657724097.db2.gz	JIDPQVUFQHKXSR-SNVBAGLBSA-N	-2	1	375.233	2.535	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]CCCCCCC(=O)[O-])c(F)cc1Cl	ZINC000794758000	658608726	/nfs/dbraw/zinc/60/87/26/658608726.db2.gz	UFWVZTADDSRKCP-UHFFFAOYSA-N	-2	1	395.836	2.579	20	0		GFADML
CC[C@H](CCC(=O)[O-])[N-]S(=O)(=O)c1c(Br)ccc(OC)c1F	ZINC000903845103	663808584	/nfs/dbraw/zinc/80/85/84/663808584.db2.gz	GUZHJUNQEDAFJC-MRVPVSSYSA-N	-2	1	398.250	2.519	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cc3c(cc2Cl)OCO3)sc1C(=O)[O-]	ZINC000319845704	563445722	/nfs/dbraw/zinc/44/57/22/563445722.db2.gz	PCEQEHOFBDZNGO-UHFFFAOYSA-N	-2	1	375.811	2.938	20	0		GFADML
NC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])c1	ZINC000410380064	563588265	/nfs/dbraw/zinc/58/82/65/563588265.db2.gz	GNHLIENSWRDWNE-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
NC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000410377004	563588414	/nfs/dbraw/zinc/58/84/14/563588414.db2.gz	XPKFDJGBNNCAGE-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
O=C(Nc1ccccn1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436758676	563679456	/nfs/dbraw/zinc/67/94/56/563679456.db2.gz	NCURLJWPFNVNJA-UHFFFAOYSA-N	-2	1	375.431	2.902	20	0		GFADML
Cc1cc(Br)ccc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(O)c1	ZINC000436868106	563683413	/nfs/dbraw/zinc/68/34/13/563683413.db2.gz	GCQBJOVGDRSPBG-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2sc(C)cc2C)cc1[N-]S(C)(=O)=O	ZINC000292310940	563782162	/nfs/dbraw/zinc/78/21/62/563782162.db2.gz	LFWWCZKTGXLVRC-UHFFFAOYSA-N	-2	1	390.508	2.546	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cccc(SC)c2)c(C(=O)[O-])cc1OC	ZINC000509104341	564282231	/nfs/dbraw/zinc/28/22/31/564282231.db2.gz	VQZGGTMSSDIDNN-UHFFFAOYSA-N	-2	1	383.447	2.925	20	0		GFADML
COC(=O)c1cc(F)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000542936136	564332755	/nfs/dbraw/zinc/33/27/55/564332755.db2.gz	KZUQKFRGOOZUPC-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1cccc(F)c1C(=O)[O-]	ZINC000479433441	564439902	/nfs/dbraw/zinc/43/99/02/564439902.db2.gz	BHIPJCDOPOFHAD-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
Cc1oc(S(=O)(=O)[N-]C[C@@H](c2ccccc2)C(F)(F)F)cc1C(=O)[O-]	ZINC000515643404	564484916	/nfs/dbraw/zinc/48/49/16/564484916.db2.gz	QJNQKAVHWWUUDZ-LBPRGKRZSA-N	-2	1	377.340	2.911	20	0		GFADML
COc1ccc(Cl)c(S(=O)(=O)Nc2ccc(C(=O)[O-])c(C(=O)[O-])c2)c1	ZINC000547545158	564492649	/nfs/dbraw/zinc/49/26/49/564492649.db2.gz	FWCCOQDWJLBLBS-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(CC(=O)[O-])cc1	ZINC000481953938	564528858	/nfs/dbraw/zinc/52/88/58/564528858.db2.gz	ZFFFWWYWPKQETN-UHFFFAOYSA-N	-3	1	381.431	2.535	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(OCC(C)(C)O)cc1	ZINC000522956918	564659426	/nfs/dbraw/zinc/65/94/26/564659426.db2.gz	NMXMAKYBJJDFGL-UHFFFAOYSA-N	-2	1	385.463	2.705	20	0		GFADML
CC1(C)CC(=O)c2cc([N-]S(=O)(=O)c3csc(C(=O)[O-])c3)ccc2O1	ZINC000552032540	564674252	/nfs/dbraw/zinc/67/42/52/564674252.db2.gz	FEUBFSCYVMPINC-UHFFFAOYSA-N	-2	1	381.431	2.991	20	0		GFADML
COc1ccc(Cl)c(S(=O)(=O)[N-]c2ccccc2[N-]S(C)(=O)=O)c1	ZINC000487402002	564685933	/nfs/dbraw/zinc/68/59/33/564685933.db2.gz	GQKJOWOFQZYODW-UHFFFAOYSA-N	-2	1	390.870	2.521	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000460826993	564781437	/nfs/dbraw/zinc/78/14/37/564781437.db2.gz	JJLYMJDQSPCGIF-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
CC[C@H](C)[C@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000534065354	564978713	/nfs/dbraw/zinc/97/87/13/564978713.db2.gz	MCQFHPBOOIGAAP-KGFZYKRKSA-N	-2	1	386.214	2.505	20	0		GFADML
CC(C)C[C@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000534065505	564978765	/nfs/dbraw/zinc/97/87/65/564978765.db2.gz	QZORKHGZYVOERM-JTQLQIEISA-N	-2	1	386.214	2.505	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C(F)F	ZINC000685209790	565099825	/nfs/dbraw/zinc/09/98/25/565099825.db2.gz	FGWUYIWNYNOWRS-ZCFIWIBFSA-N	-2	1	395.733	2.993	20	0		GFADML
CC(C)=CCSC[C@@H]([N-]S(=O)(=O)c1ncccc1C(F)(F)F)C(=O)[O-]	ZINC000593257061	565323222	/nfs/dbraw/zinc/32/32/22/565323222.db2.gz	QKRUFIVAIKHBCV-LLVKDONJSA-N	-2	1	398.428	2.531	20	0		GFADML
CC1(C)CCC[C@@]([N-]S(=O)(=O)c2ncccc2C(F)(F)F)(C(=O)[O-])C1	ZINC000629335136	565844984	/nfs/dbraw/zinc/84/49/84/565844984.db2.gz	LQVDHHQAOXLTFP-AWEZNQCLSA-N	-2	1	380.388	2.802	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])cc1C(=O)[O-]	ZINC000606343045	565962579	/nfs/dbraw/zinc/96/25/79/565962579.db2.gz	WSEUKXWXHPHLDU-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
Cc1cnn(-c2ccc(S(=O)(=O)[N-]c3ccccc3CC(=O)[O-])cc2F)c1	ZINC000818970910	596977147	/nfs/dbraw/zinc/97/71/47/596977147.db2.gz	VILIZUCDSQSNKA-UHFFFAOYSA-N	-2	1	389.408	2.748	20	0		GFADML
O=C([O-])C1(NC(=O)c2ccc([N-]S(=O)(=O)c3ccccc3)cc2)CCCC1	ZINC000262584288	597037032	/nfs/dbraw/zinc/03/70/32/597037032.db2.gz	RWLUPLXUEUHYKI-UHFFFAOYSA-N	-2	1	388.445	2.615	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccccc2CC(=O)[O-])c1	ZINC000818516999	597315396	/nfs/dbraw/zinc/31/53/96/597315396.db2.gz	OWHGNTYBZWSCQP-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1Cl)c1nc(C2CC2)no1	ZINC000736389185	599775201	/nfs/dbraw/zinc/77/52/01/599775201.db2.gz	FSKGJYNYZYFEBI-ZDUSSCGKSA-N	-2	1	399.856	2.974	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NC[C@H](C)C(=O)[O-])cc2)cc1C	ZINC000262493257	599778889	/nfs/dbraw/zinc/77/88/89/599778889.db2.gz	GOJHXXLTBCZCDI-AWEZNQCLSA-N	-2	1	390.461	2.555	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)NC[C@H](C)C(=O)[O-])ccc2C)cc1	ZINC000485927218	599779449	/nfs/dbraw/zinc/77/94/49/599779449.db2.gz	QHEKQUMZPZUBCA-AWEZNQCLSA-N	-2	1	390.461	2.555	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)NC[C@H](C)C(=O)[O-])cc2)c1C	ZINC000262532071	599779490	/nfs/dbraw/zinc/77/94/90/599779490.db2.gz	PGJPKJJARULLOU-ZDUSSCGKSA-N	-2	1	390.461	2.555	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2)c1	ZINC000485342385	600025362	/nfs/dbraw/zinc/02/53/62/600025362.db2.gz	OEMZEMUWZHKPSY-UHFFFAOYSA-N	-2	1	396.852	2.688	20	0		GFADML
O=Cc1ccc(OC(F)(F)C(=O)[N-][C@H](C(=O)[O-])c2cc(F)ccc2F)cc1	ZINC000740317167	600068071	/nfs/dbraw/zinc/06/80/71/600068071.db2.gz	DYTWRZIKUAOMRO-AWEZNQCLSA-N	-2	1	385.269	2.691	20	0		GFADML
CC(C)(C)NC(=O)c1cccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])c1	ZINC000736262534	600095582	/nfs/dbraw/zinc/09/55/82/600095582.db2.gz	KKSQNGIFCXFWNV-UHFFFAOYSA-N	-2	1	394.424	2.853	20	0		GFADML
CC(=O)c1cccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2N2CCCC2)c1	ZINC000736196517	600102980	/nfs/dbraw/zinc/10/29/80/600102980.db2.gz	PUOSCRNKQVXSRL-UHFFFAOYSA-N	-2	1	388.445	2.988	20	0		GFADML
CCN(C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)[C@H]1CCCC[C@H]1C	ZINC000737059039	600121061	/nfs/dbraw/zinc/12/10/61/600121061.db2.gz	ZGCCNNZREBAFNX-KDOFPFPSSA-N	-2	1	385.464	2.834	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)c1	ZINC000737694539	600300883	/nfs/dbraw/zinc/30/08/83/600300883.db2.gz	DBGOSLUXIUHDOA-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CNC(=O)[O-])cc1	ZINC000737257873	600302199	/nfs/dbraw/zinc/30/21/99/600302199.db2.gz	QYRICMBSHRFKNN-UHFFFAOYSA-N	-3	1	378.406	2.516	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCC[C@]4(CC=CCC4)C3)cc2)[n-]1	ZINC000739877064	600425084	/nfs/dbraw/zinc/42/50/84/600425084.db2.gz	JGTVYUBEAPVLCO-JOCHJYFZSA-N	-2	1	395.459	2.755	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(N2CCCC2=O)c(F)c1	ZINC000477396615	600458033	/nfs/dbraw/zinc/45/80/33/600458033.db2.gz	ZYKZBIWMNOYGNE-UHFFFAOYSA-N	-2	1	392.408	2.760	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(OCCCC(=O)[O-])cc2)c1	ZINC000737712219	600489004	/nfs/dbraw/zinc/48/90/04/600489004.db2.gz	GMIXDGBBOMHCBW-UHFFFAOYSA-N	-2	1	393.417	2.518	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(N2CCOC2=O)cc1	ZINC000740133685	600694072	/nfs/dbraw/zinc/69/40/72/600694072.db2.gz	AUCIYBDLLSVKEF-UHFFFAOYSA-N	-2	1	396.808	2.796	20	0		GFADML
CCN(Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)[O-])c1)C(C)=O	ZINC000032627058	600809778	/nfs/dbraw/zinc/80/97/78/600809778.db2.gz	UMLDBFCVNANYEB-UHFFFAOYSA-N	-2	1	390.461	2.862	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3cccc(C)c3C(=O)[O-])ccc2o1	ZINC000831831945	601230546	/nfs/dbraw/zinc/23/05/46/601230546.db2.gz	SQWCDVHJNUZXMT-UHFFFAOYSA-N	-2	1	376.390	2.782	20	0		GFADML
COc1cc(C)c([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1OC	ZINC000831966991	601319514	/nfs/dbraw/zinc/31/95/14/601319514.db2.gz	MTQPOOZYDHRFOJ-TWGQIWQCSA-N	-2	1	377.418	2.911	20	0		GFADML
COCCOCc1cccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000831767340	601324805	/nfs/dbraw/zinc/32/48/05/601324805.db2.gz	LDJPJHOKUROUFZ-YFHOEESVSA-N	-2	1	391.445	2.748	20	0		GFADML
C/C(=C/COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(F)cc2)c1)C(=O)[O-]	ZINC000825781852	601406103	/nfs/dbraw/zinc/40/61/03/601406103.db2.gz	ZIYKHJOMJIZPAV-XFXZXTDPSA-N	-2	1	393.392	2.814	20	0		GFADML
Cc1c(C(=O)[O-])c2cc(OS(=O)(=O)c3cnc(C(C)C)[n-]3)ccc2n1C	ZINC000832852355	601585400	/nfs/dbraw/zinc/58/54/00/601585400.db2.gz	SRODPEPEABSHLV-UHFFFAOYSA-N	-2	1	377.422	2.799	20	0		GFADML
Cc1c(C(=O)[O-])c2cc(OS(=O)(=O)c3c[n-]c(C(C)C)n3)ccc2n1C	ZINC000832852355	601585402	/nfs/dbraw/zinc/58/54/02/601585402.db2.gz	SRODPEPEABSHLV-UHFFFAOYSA-N	-2	1	377.422	2.799	20	0		GFADML
Cc1sc(C(=O)[O-])cc1COC(=O)c1sccc1[N-]S(C)(=O)=O	ZINC000833031250	601723856	/nfs/dbraw/zinc/72/38/56/601723856.db2.gz	JTEHMDZSDGNPTM-UHFFFAOYSA-N	-2	1	375.449	2.545	20	0		GFADML
CC[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)cc1)C(=O)[O-]	ZINC000262958160	601749386	/nfs/dbraw/zinc/74/93/86/601749386.db2.gz	JSEXVSQWDRNMFY-QGZVFWFLSA-N	-2	1	390.461	2.697	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)ccc2o1	ZINC000831795702	601795143	/nfs/dbraw/zinc/79/51/43/601795143.db2.gz	GGZJZNXEMNFBNJ-UHFFFAOYSA-N	-2	1	394.380	2.655	20	0		GFADML
CCOC(=O)Nc1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000829865709	601858045	/nfs/dbraw/zinc/85/80/45/601858045.db2.gz	HZOAPQHWNMFQGV-UHFFFAOYSA-N	-2	1	382.369	2.893	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)CCC(=O)[O-])c2)cc1C(=O)[O-]	ZINC000439627705	602308924	/nfs/dbraw/zinc/30/89/24/602308924.db2.gz	WAGIXGGLCIBSBU-UHFFFAOYSA-N	-3	1	391.401	2.542	20	0		GFADML
CC[C@H](NC(=O)[O-])C(=O)Nc1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1	ZINC000739531906	602390371	/nfs/dbraw/zinc/39/03/71/602390371.db2.gz	YCEUKGIMPHVMQR-ZDUSSCGKSA-N	-2	1	395.412	2.611	20	0		GFADML
O=C([O-])Nc1ccc(F)c([N-]S(=O)(=O)c2cnn(Cc3ccccc3)c2)c1	ZINC000740702855	602653346	/nfs/dbraw/zinc/65/33/46/602653346.db2.gz	DMZQWTRNBDICFU-UHFFFAOYSA-N	-2	1	390.396	2.961	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCCN(C(=O)CC3CCCC3)CC2)c([O-])c1	ZINC000740700498	602848226	/nfs/dbraw/zinc/84/82/26/602848226.db2.gz	ZCZSZIZQUHMVHZ-UHFFFAOYSA-N	-2	1	389.452	2.737	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NC[C@H](O)c2ccccc2C(F)(F)F)c([O-])c1	ZINC000740697955	602855899	/nfs/dbraw/zinc/85/58/99/602855899.db2.gz	HRPDKVQJXZHWLQ-AWEZNQCLSA-N	-2	1	384.310	2.964	20	0		GFADML
O=C([O-])N1CCC[C@H]([N-]S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)C1	ZINC000739927470	603085878	/nfs/dbraw/zinc/08/58/78/603085878.db2.gz	PANLRDGCLGYFGQ-QMMMGPOBSA-N	-2	1	386.779	2.780	20	0		GFADML
CSc1ccc(S(=O)(=O)[N-]c2cccc(OCCNC(=O)[O-])c2)cc1	ZINC000829766350	603398672	/nfs/dbraw/zinc/39/86/72/603398672.db2.gz	HVAOEZDVXVEDAN-UHFFFAOYSA-N	-2	1	382.463	2.856	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)cc1	ZINC000828693813	603403310	/nfs/dbraw/zinc/40/33/10/603403310.db2.gz	CBFIVBBPVZQSBR-LBPRGKRZSA-N	-2	1	392.433	2.532	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)cc1F	ZINC000754759191	604631590	/nfs/dbraw/zinc/63/15/90/604631590.db2.gz	QABAUOWNZLRCNG-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)Nc3ccc(C4CC4)cc3)cc2)[n-]1	ZINC000833776374	604993529	/nfs/dbraw/zinc/99/35/29/604993529.db2.gz	UXCZJMVKFRLQBC-UHFFFAOYSA-N	-2	1	377.400	2.922	20	0		GFADML
O=C([O-])N[C@@H](CC(=O)OCc1cc(=O)oc2cc([O-])ccc12)c1ccccc1	ZINC000832113361	605556775	/nfs/dbraw/zinc/55/67/75/605556775.db2.gz	BQRZBZBCIMXZEH-INIZCTEOSA-N	-2	1	383.356	2.941	20	0		GFADML
CC(C)c1cccc(S(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)c1	ZINC000820198293	606707469	/nfs/dbraw/zinc/70/74/69/606707469.db2.gz	UTQBORMIWTXPII-UHFFFAOYSA-N	-2	1	389.485	2.742	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2SC)cc1OC	ZINC000013278947	654503943	/nfs/dbraw/zinc/50/39/43/654503943.db2.gz	AXKYTVHOVQDZCU-UHFFFAOYSA-N	-2	1	383.447	2.925	20	0		GFADML
O=C(N[N-]S(=O)(=O)c1cccc(Cl)c1Cl)c1ccc(Cl)cc1[O-]	ZINC000055665151	654780157	/nfs/dbraw/zinc/78/01/57/654780157.db2.gz	WGGBSUBQCAQAMT-UHFFFAOYSA-N	-2	1	395.651	2.976	20	0		GFADML
NC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)c(Cl)c(C(=O)[O-])c2)cc1	ZINC000058488333	654818488	/nfs/dbraw/zinc/81/84/88/654818488.db2.gz	HLWKIFZKCRYYPH-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)c1ccc(Br)c([O-])c1	ZINC000133023429	654952346	/nfs/dbraw/zinc/95/23/46/654952346.db2.gz	JVBYFKGMFAJWFH-UHFFFAOYSA-N	-2	1	394.250	2.725	20	0		GFADML
C[C@]1(C(=O)[O-])CCCC[C@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000135572852	655020980	/nfs/dbraw/zinc/02/09/80/655020980.db2.gz	XGVXLWSJTXNLEG-SKDRFNHKSA-N	-2	1	382.301	2.822	20	0		GFADML
COc1ccc(Cl)c(S(=O)(=O)[N-]N=c2c(F)c(F)[n-]c(F)c2F)c1	ZINC000112266121	655186058	/nfs/dbraw/zinc/18/60/58/655186058.db2.gz	RNUIFDYOFBMCBA-UHFFFAOYSA-N	-2	1	385.726	2.605	20	0		GFADML
O=C([O-])C[C@@H](CC[N-]S(=O)(=O)c1ccc(Cl)nc1Cl)C(F)(F)F	ZINC000285001491	655343026	/nfs/dbraw/zinc/34/30/26/655343026.db2.gz	GYQBAJHJRMDGJE-ZCFIWIBFSA-N	-2	1	395.186	2.710	20	0		GFADML
Cc1cc(C(N)=O)ccc1[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(Cl)c1C	ZINC000747607863	655780450	/nfs/dbraw/zinc/78/04/50/655780450.db2.gz	GNJYPPKFDXBNRB-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
COc1cc(F)c([N-]S(=O)(=O)c2cc(C(=O)[O-])c(C)cc2F)cc1F	ZINC000753781519	655858655	/nfs/dbraw/zinc/85/86/55/655858655.db2.gz	BOIHQRSZILINHG-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
Cc1n[nH]c(C(F)F)c1[N-]S(=O)(=O)c1cc(Cl)c(F)c(C(=O)[O-])c1	ZINC000758168957	655925150	/nfs/dbraw/zinc/92/51/50/655925150.db2.gz	ILMNTRGJYDVBFL-UHFFFAOYSA-N	-2	1	383.735	2.947	20	0		GFADML
CCc1cc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2Cl)on1	ZINC000761289532	656008148	/nfs/dbraw/zinc/00/81/48/656008148.db2.gz	UMPVKQYNOAWSLR-UHFFFAOYSA-N	-2	1	379.221	2.721	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)c1	ZINC000767734551	656217513	/nfs/dbraw/zinc/21/75/13/656217513.db2.gz	HBQTYRXGRKMMKF-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1cccc(C(=O)[O-])c1[N-]S(=O)(=O)c1cc(Cl)c(F)c(C(=O)[O-])c1	ZINC000767736653	656217613	/nfs/dbraw/zinc/21/76/13/656217613.db2.gz	LZGLKFSOZIXMPB-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)c1C(=O)[O-]	ZINC000767740932	656218412	/nfs/dbraw/zinc/21/84/12/656218412.db2.gz	XIMDWCQARDOSKC-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])c1ccc(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1C(=O)[O-]	ZINC000776453565	656743744	/nfs/dbraw/zinc/74/37/44/656743744.db2.gz	OIYWNQKGGRADSG-UHFFFAOYSA-N	-2	1	391.188	2.586	20	0		GFADML
Cc1cc(F)c(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cl)cc1C(=O)[O-]	ZINC000793380324	658392490	/nfs/dbraw/zinc/39/24/90/658392490.db2.gz	GKXYXDCDLFLLAN-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
Cc1cc(S(=O)(=O)[N-][C@@H](C[C@@H]2CCCO2)C(F)(F)F)sc1C(=O)[O-]	ZINC000871979728	662748875	/nfs/dbraw/zinc/74/88/75/662748875.db2.gz	SCRANXCFRMFUJM-IUCAKERBSA-N	-2	1	387.401	2.533	20	0		GFADML
O=C([O-])[C@@H](C[C@H]1CCCO1)[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000906002480	663907623	/nfs/dbraw/zinc/90/76/23/663907623.db2.gz	YMZWEHWAPBLGEU-MWLCHTKSSA-N	-2	1	389.882	2.855	20	0		GFADML
N#Cc1cc(Br)cc(S(=O)(=O)[N-]c2ccc(CC(=O)[O-])cc2)c1	ZINC000185570063	552366040	/nfs/dbraw/zinc/36/60/40/552366040.db2.gz	LECLKVJXERBZGT-UHFFFAOYSA-N	-2	1	395.234	2.749	20	0		GFADML
Cc1noc(C)c1S(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1Br	ZINC000230350766	553064935	/nfs/dbraw/zinc/06/49/35/553064935.db2.gz	QYFZQWDFZTUZJL-UHFFFAOYSA-N	-2	1	375.200	2.553	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(OC[C@@H]3CCCO3)cc2)cs1	ZINC000298856549	563368755	/nfs/dbraw/zinc/36/87/55/563368755.db2.gz	NPZCZKNAVSWCPO-ZDUSSCGKSA-N	-2	1	383.447	2.805	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(Br)cc2)ccc1C(=O)[O-]	ZINC000318473088	563444210	/nfs/dbraw/zinc/44/42/10/563444210.db2.gz	KDVTYTYILVZDNE-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
Cc1cc(O)c(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(F)(F)F)nc1	ZINC000327018963	563456763	/nfs/dbraw/zinc/45/67/63/563456763.db2.gz	HRUHDYGAKFYQHH-UHFFFAOYSA-N	-2	1	376.312	2.613	20	0		GFADML
COc1nc2ccc(NS(=O)(=O)c3cc(C(=O)[O-])ccc3[O-])cc2s1	ZINC000430979945	563550829	/nfs/dbraw/zinc/55/08/29/563550829.db2.gz	QLGLFQGPFQLWKX-UHFFFAOYSA-N	-2	1	380.403	2.510	20	0		GFADML
O=C([O-])c1cc(F)cc(S(=O)(=O)[N-]c2ccc(-c3nncs3)cc2)c1	ZINC000436479485	563672179	/nfs/dbraw/zinc/67/21/79/563672179.db2.gz	UMOFXKDYUKGXSJ-UHFFFAOYSA-N	-2	1	379.394	2.843	20	0		GFADML
O=C([O-])c1ccc([O-])c(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2)c1	ZINC000436892827	563684043	/nfs/dbraw/zinc/68/40/43/563684043.db2.gz	LEFHYOXWBNSRAT-UHFFFAOYSA-N	-2	1	377.296	2.790	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(O)c2)cc1C(=O)[O-]	ZINC000436953939	563685477	/nfs/dbraw/zinc/68/54/77/563685477.db2.gz	SSNCITXPIWUFNT-UHFFFAOYSA-N	-3	1	385.781	2.551	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc3scnc3c2)cc1CC(=O)[O-]	ZINC000538139364	564183490	/nfs/dbraw/zinc/18/34/90/564183490.db2.gz	UUOHXXGCNRTPCJ-UHFFFAOYSA-N	-2	1	378.431	2.733	20	0		GFADML
O=C([O-])c1cccc(CC[N-]S(=O)(=O)c2ccc(Cl)c(F)c2Cl)n1	ZINC000541002326	564263444	/nfs/dbraw/zinc/26/34/44/564263444.db2.gz	SOEIHVBCDXBGIF-UHFFFAOYSA-N	-2	1	393.223	2.747	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000475747760	564316901	/nfs/dbraw/zinc/31/69/01/564316901.db2.gz	JUODYYMCINLPDS-UHFFFAOYSA-N	-2	1	381.797	2.729	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2cccc3c2CCO3)cc1Cl	ZINC000478697785	564412116	/nfs/dbraw/zinc/41/21/16/564412116.db2.gz	ORDLOCBRNPPOFN-UHFFFAOYSA-N	-2	1	383.809	2.539	20	0		GFADML
COc1cccc(F)c1[N-]S(=O)(=O)c1cc(OC)c(C(=O)[O-])cc1Cl	ZINC000479554310	564443667	/nfs/dbraw/zinc/44/36/67/564443667.db2.gz	LELLKLVWWLDANG-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
O=C([O-])[C@@H](CC1CCCC1)[N-]S(=O)(=O)c1sccc1Br	ZINC000547571055	564495843	/nfs/dbraw/zinc/49/58/43/564495843.db2.gz	RSTOLBRGRNGFKM-SNVBAGLBSA-N	-2	1	382.301	2.822	20	0		GFADML
O=C([O-])C[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C1CCOCC1	ZINC000547617170	564504247	/nfs/dbraw/zinc/50/42/47/564504247.db2.gz	IKQAWZLGWVLXNU-QMMMGPOBSA-N	-2	1	388.294	2.603	20	0		GFADML
NC(=O)c1ccc(S(=O)(=O)[N-]c2cc(Cl)c(Cl)c(C(=O)[O-])c2)cc1	ZINC000481453259	564512414	/nfs/dbraw/zinc/51/24/14/564512414.db2.gz	UZPAFBRZZPRAOB-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
C[C@@H](CCC(=O)[O-])C[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000547891940	564516801	/nfs/dbraw/zinc/51/68/01/564516801.db2.gz	SAHUWIVCYQPESF-LURJTMIESA-N	-2	1	390.708	2.943	20	0		GFADML
C[C@@H](C[N-]S(=O)(=O)c1cc(Br)sc1Cl)CC(=O)[O-]	ZINC000548594653	564565938	/nfs/dbraw/zinc/56/59/38/564565938.db2.gz	YRLMICJWEOBFCP-RXMQYKEDSA-N	-2	1	376.681	2.553	20	0		GFADML
COc1cccc(C[C@@H](C[N-]S(=O)(=O)c2sccc2Cl)C(=O)[O-])c1	ZINC000572362178	564591376	/nfs/dbraw/zinc/59/13/76/564591376.db2.gz	KDQGHJOWOLNVSL-NSHDSACASA-N	-2	1	389.882	2.632	20	0		GFADML
Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000484970656	564603208	/nfs/dbraw/zinc/60/32/08/564603208.db2.gz	HGLKQKPYIPXWRM-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cc3c(cc2F)NC(=O)CC3)sc1C(=O)[O-]	ZINC000488993061	564726456	/nfs/dbraw/zinc/72/64/56/564726456.db2.gz	BCNFORBOPNIHIV-UHFFFAOYSA-N	-2	1	384.410	2.579	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(F)c1	ZINC000489560073	564744025	/nfs/dbraw/zinc/74/40/25/564744025.db2.gz	QRWUHGZVNWWDEO-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)ccc1C	ZINC000467070838	564954926	/nfs/dbraw/zinc/95/49/26/564954926.db2.gz	GLXNJNASQJGIQP-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC[C@H]2C[C@H]2C1	ZINC000619346270	565337408	/nfs/dbraw/zinc/33/74/08/565337408.db2.gz	HAZBJABZUAQHQE-RYUDHWBXSA-N	-2	1	378.475	2.737	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc3n[nH]cc32)cc1Br	ZINC000673884350	565851494	/nfs/dbraw/zinc/85/14/94/565851494.db2.gz	NSOWPHUOCBFFIQ-UHFFFAOYSA-N	-2	1	396.222	2.824	20	0		GFADML
O=C([O-])[C@]1(C[N-]S(=O)(=O)c2sc3ccccc3c2Cl)CCCOC1	ZINC000630432930	565900980	/nfs/dbraw/zinc/90/09/80/565900980.db2.gz	PUSCTSVHFLIMGU-HNNXBMFYSA-N	-2	1	389.882	2.714	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2c(C)c(Cl)ccc2C(=O)[O-])c1	ZINC000604307288	565927396	/nfs/dbraw/zinc/92/73/96/565927396.db2.gz	ICGRKCSDIFTPHI-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H]2CCCCCC[C@H]2C(=O)[O-])c(F)c1	ZINC000681580501	566115691	/nfs/dbraw/zinc/11/56/91/566115691.db2.gz	WGMSJEBEXPTYIX-RISCZKNCSA-N	-2	1	377.409	2.675	20	0		GFADML
O=C([O-])c1ccc(Cl)c(S(=O)(=O)Nc2cc(F)c(F)cc2C(=O)[O-])c1	ZINC000728854747	599752980	/nfs/dbraw/zinc/75/29/80/599752980.db2.gz	RSTKDESFVHHABT-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(CCC(=O)[O-])cc1	ZINC000737256400	599853238	/nfs/dbraw/zinc/85/32/38/599853238.db2.gz	HVCIONNEYDPMSJ-UHFFFAOYSA-N	-3	1	377.418	2.765	20	0		GFADML
COCc1cccc(S(=O)(=O)[N-]c2cccc(CSCC(=O)[O-])c2)c1	ZINC000737834274	599926248	/nfs/dbraw/zinc/92/62/48/599926248.db2.gz	AJWCMDAYBLFKDZ-UHFFFAOYSA-N	-2	1	381.475	2.952	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)OCc2ccc(F)cc2C(=O)[O-])o1	ZINC000736262775	600114618	/nfs/dbraw/zinc/11/46/18/600114618.db2.gz	RJCMDMHPPUQLCN-UHFFFAOYSA-N	-2	1	399.396	2.551	20	0		GFADML
O=C([O-])CCCc1nc(COC(=O)c2ccc(Cl)c(Cl)c2[O-])no1	ZINC000739702387	600192847	/nfs/dbraw/zinc/19/28/47/600192847.db2.gz	FULKILHKFDQPNL-UHFFFAOYSA-N	-2	1	375.164	2.846	20	0		GFADML
CSc1nc(C)c(CCC(=O)Nc2ccc(CNC(=O)[O-])cc2)c(=O)[n-]1	ZINC000738207533	600293094	/nfs/dbraw/zinc/29/30/94/600293094.db2.gz	FVKLRLXNJJQGBV-UHFFFAOYSA-N	-2	1	376.438	2.551	20	0		GFADML
CC[C@H](C)[C@@H]1CCCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736880129	600409444	/nfs/dbraw/zinc/40/94/44/600409444.db2.gz	LMZFRJVXDMLORG-KSSFIOAISA-N	-2	1	385.464	2.834	20	0		GFADML
CC[C@@H](C)[C@@H]1CCCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736880128	600409489	/nfs/dbraw/zinc/40/94/89/600409489.db2.gz	LMZFRJVXDMLORG-KDOFPFPSSA-N	-2	1	385.464	2.834	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@H](C(=O)[O-])c1ccc(F)cc1	ZINC000737039051	600451617	/nfs/dbraw/zinc/45/16/17/600451617.db2.gz	NQFXCAFBGGJNCA-INIZCTEOSA-N	-2	1	395.408	2.960	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)c(C)c1	ZINC000050532623	600482912	/nfs/dbraw/zinc/48/29/12/600482912.db2.gz	JMSABLJTUKYKOY-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2cccc(Oc3cnccn3)c2)cc1	ZINC000481979278	600627171	/nfs/dbraw/zinc/62/71/71/600627171.db2.gz	GTACSXKQSFLAMW-UHFFFAOYSA-N	-2	1	385.401	2.697	20	0		GFADML
Cc1cnn(-c2ccc([N-]S(=O)(=O)c3ccccc3C(=O)[O-])cc2F)c1	ZINC000738809238	600636531	/nfs/dbraw/zinc/63/65/31/600636531.db2.gz	QPGVZYBISKZWHW-UHFFFAOYSA-N	-2	1	375.381	2.819	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2c(C)cc(OC)cc2C)cc1C(=O)[O-]	ZINC000831435425	600690053	/nfs/dbraw/zinc/69/00/53/600690053.db2.gz	WIWOVIASXDSMLL-UHFFFAOYSA-N	-2	1	393.417	2.598	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc(N3CCOC3=O)c2C)ccc1C(=O)[O-]	ZINC000795326027	600691347	/nfs/dbraw/zinc/69/13/47/600691347.db2.gz	HRQFPHHTGUBLKP-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
CC(C)C[C@@H](C[N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000794915215	600765108	/nfs/dbraw/zinc/76/51/08/600765108.db2.gz	USAABEMFHBBLIO-QMMMGPOBSA-N	-2	1	399.694	2.523	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)ccc1C	ZINC000831348415	600816934	/nfs/dbraw/zinc/81/69/34/600816934.db2.gz	KNTQXCVZRBZEKE-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737939398	600890638	/nfs/dbraw/zinc/89/06/38/600890638.db2.gz	HAAGCBSPVABKGX-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
CC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000736123008	600891913	/nfs/dbraw/zinc/89/19/13/600891913.db2.gz	BATCXAJORSWLRP-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)cc1C	ZINC000737701937	600893211	/nfs/dbraw/zinc/89/32/11/600893211.db2.gz	JXVNQIYDVCZDCB-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccccc2CC(F)(F)F)ccc1O	ZINC000740089968	601050852	/nfs/dbraw/zinc/05/08/52/601050852.db2.gz	QPXAXQKBAIFTEU-UHFFFAOYSA-N	-2	1	375.324	2.996	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1C(=O)N(C)C	ZINC000477410902	601250633	/nfs/dbraw/zinc/25/06/33/601250633.db2.gz	AGLRAQBOFDCWNN-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)ccc1Cl	ZINC000044330272	601321664	/nfs/dbraw/zinc/32/16/64/601321664.db2.gz	JQIZGSRQKCGZQS-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CNC(=O)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)ccc1Cl	ZINC000614855065	601324643	/nfs/dbraw/zinc/32/46/43/601324643.db2.gz	HCPFMWPBZIOOBL-UHFFFAOYSA-N	-2	1	396.852	2.815	20	0		GFADML
CCN(CC)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(C(=O)[O-])c2)cc1	ZINC000266560407	601334593	/nfs/dbraw/zinc/33/45/93/601334593.db2.gz	JMXGFZGGCHSHIM-UHFFFAOYSA-N	-2	1	390.461	2.976	20	0		GFADML
CC[C@@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000828671487	601478785	/nfs/dbraw/zinc/47/87/85/601478785.db2.gz	DLPNOPAHFQLIBU-LBPRGKRZSA-N	-2	1	386.214	2.649	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl)C(=O)[O-]	ZINC000035085772	601572565	/nfs/dbraw/zinc/57/25/65/601572565.db2.gz	GXTYMSOTWQXUSY-QMMMGPOBSA-N	-2	1	391.070	2.897	20	0		GFADML
CC(C)(CNC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-])C(=O)[O-]	ZINC000826602134	601818802	/nfs/dbraw/zinc/81/88/02/601818802.db2.gz	UMCYCLPEJSROOX-UHFFFAOYSA-N	-2	1	392.358	2.763	20	0		GFADML
Cc1cc(C(=O)[O-])ccc1S(=O)(=O)Nc1cc(C(=O)[O-])ccc1OC(C)C	ZINC000466289224	601860382	/nfs/dbraw/zinc/86/03/82/601860382.db2.gz	OUYDNSLFHVYDCL-UHFFFAOYSA-N	-2	1	393.417	2.979	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc(OCC(=O)[O-])cc1	ZINC000444670177	601881035	/nfs/dbraw/zinc/88/10/35/601881035.db2.gz	AAXQAZVWIPBNQC-UHFFFAOYSA-N	-3	1	399.808	2.611	20	0		GFADML
O=C([O-])Cc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc3c2CCCC3)c1	ZINC000461872343	601987429	/nfs/dbraw/zinc/98/74/29/601987429.db2.gz	RXXYZIAJQVERGT-UHFFFAOYSA-N	-3	1	389.429	2.692	20	0		GFADML
Cc1nc(C)n(-c2ccccc2[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)n1	ZINC000477465316	601988990	/nfs/dbraw/zinc/98/89/90/601988990.db2.gz	INQYLHGVAFPVKW-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
Cc1nc(C)n(-c2ccccc2[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)n1	ZINC000477440514	601989164	/nfs/dbraw/zinc/98/91/64/601989164.db2.gz	BMFIOQSSFVRPND-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])cc1	ZINC000739211613	602244872	/nfs/dbraw/zinc/24/48/72/602244872.db2.gz	ZHTQFESITPKPNF-UHFFFAOYSA-N	-2	1	389.433	2.876	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)c1	ZINC000532851695	602321813	/nfs/dbraw/zinc/32/18/13/602321813.db2.gz	XAQWTQZMOYJACC-UHFFFAOYSA-N	-2	1	381.381	2.728	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(N(C)C(C)=O)cc2)ccc1NC(=O)[O-]	ZINC000739870662	602819696	/nfs/dbraw/zinc/81/96/96/602819696.db2.gz	VGGGZNBVQSYNRF-UHFFFAOYSA-N	-2	1	393.421	2.569	20	0		GFADML
CCN1C[C@H](CN(C)C(=O)c2ccc(NC(=O)[O-])cc2[O-])Oc2ccccc21	ZINC000739452281	602842606	/nfs/dbraw/zinc/84/26/06/602842606.db2.gz	RMAGMYGXOCIPPS-AWEZNQCLSA-N	-2	1	385.420	2.842	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCN(c3ccc4ccccc4n3)CC2)c([O-])c1	ZINC000740699617	602849784	/nfs/dbraw/zinc/84/97/84/602849784.db2.gz	TTXHQLSJSQOWOE-UHFFFAOYSA-N	-2	1	392.415	2.993	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)c(C)c1	ZINC000828788060	603400262	/nfs/dbraw/zinc/40/02/62/603400262.db2.gz	BUFQMFVWOQUOHZ-GFCCVEGCSA-N	-2	1	392.433	2.911	20	0		GFADML
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)cc1	ZINC000827350726	603400621	/nfs/dbraw/zinc/40/06/21/603400621.db2.gz	YIVKLLLYBKJDEA-LBPRGKRZSA-N	-2	1	392.433	2.993	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)c1	ZINC000828771820	603400883	/nfs/dbraw/zinc/40/08/83/603400883.db2.gz	GLTPLNPCXQMOJH-LBPRGKRZSA-N	-2	1	392.433	2.911	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC(N(CC2CC2)C(=O)[O-])CC1	ZINC000830709756	603465664	/nfs/dbraw/zinc/46/56/64/603465664.db2.gz	QEJJHWFCSMVWGF-UHFFFAOYSA-N	-2	1	376.457	2.609	20	0		GFADML
COCCOc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])cc1	ZINC000829013733	604013943	/nfs/dbraw/zinc/01/39/43/604013943.db2.gz	RGXQYIMRISAAOX-UHFFFAOYSA-N	-2	1	392.433	2.553	20	0		GFADML
Cc1ccc(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])c(N2CCOCC2)c1	ZINC000830316674	604022017	/nfs/dbraw/zinc/02/20/17/604022017.db2.gz	BVHLKERULHJJQE-UHFFFAOYSA-N	-2	1	385.420	2.557	20	0		GFADML
Cc1nnc(-c2cccc([N-]S(=O)(=O)c3ccc(C(=O)[O-])c(C)c3)c2)n1C	ZINC000367008175	604792468	/nfs/dbraw/zinc/79/24/68/604792468.db2.gz	FMXAPRMBCDVAKO-UHFFFAOYSA-N	-2	1	386.433	2.598	20	0		GFADML
CCC(=O)c1cccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])cc(C(=O)OC)c2)c1	ZINC000833636046	605008408	/nfs/dbraw/zinc/00/84/08/605008408.db2.gz	FNNBUMBYTCMQNG-UHFFFAOYSA-N	-2	1	391.401	2.565	20	0		GFADML
COCc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2N2CCCC2)cc1	ZINC000833725813	605049943	/nfs/dbraw/zinc/04/99/43/605049943.db2.gz	HEUHXYPNFLWFOJ-UHFFFAOYSA-N	-2	1	390.461	2.932	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(C3(C(=O)[O-])CC3)cc2)cc(OC)c1	ZINC000833728919	605124699	/nfs/dbraw/zinc/12/46/99/605124699.db2.gz	FNOZXMHCHGLOFQ-UHFFFAOYSA-N	-2	1	377.418	2.621	20	0		GFADML
COC(=O)C1(c2ccc(S(=O)(=O)[N-]c3cccc(NC(=O)[O-])c3)cc2)CC1	ZINC000833701596	605125034	/nfs/dbraw/zinc/12/50/34/605125034.db2.gz	DVFWPVINHTTXQE-UHFFFAOYSA-N	-2	1	390.417	2.782	20	0		GFADML
Cc1ccc([C@H](C[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)C(=O)[O-])cc1	ZINC000833749940	605293530	/nfs/dbraw/zinc/29/35/30/605293530.db2.gz	ZSPIEEFDNDACQY-NSHDSACASA-N	-2	1	389.260	2.844	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCc3c(ncn3-c3ccccc3)C2)c([O-])c1	ZINC000834254168	605477142	/nfs/dbraw/zinc/47/71/42/605477142.db2.gz	AMTTVQONQORCBQ-UHFFFAOYSA-N	-2	1	378.388	2.866	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCCC[C@H]2c2nnc3n2CCCC3)c([O-])c1	ZINC000834254165	605654837	/nfs/dbraw/zinc/65/48/37/605654837.db2.gz	AKNTYKRGAHGSGD-AWEZNQCLSA-N	-2	1	385.424	2.777	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)c([O-])c1	ZINC000834258440	605656034	/nfs/dbraw/zinc/65/60/34/605656034.db2.gz	PRISFICCCWFKDF-OAHLLOKOSA-N	-2	1	384.388	2.596	20	0		GFADML
O=C([O-])NCCc1ccc(CNC(=O)c2ccc(Br)c([O-])c2)cc1	ZINC000834244524	605916879	/nfs/dbraw/zinc/91/68/79/605916879.db2.gz	CJCCZNBOCHEOEU-UHFFFAOYSA-N	-2	1	393.237	2.895	20	0		GFADML
CC(C)CCc1ccc(S(=O)(=O)[N-]c2ncc(-c3nn[n-]n3)s2)cc1	ZINC000820081512	607025064	/nfs/dbraw/zinc/02/50/64/607025064.db2.gz	JSKOQOMQTQEHER-UHFFFAOYSA-N	-2	1	378.483	2.713	20	0		GFADML
O=C(NOCCC1CC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000817383566	660192941	/nfs/dbraw/zinc/19/29/41/660192941.db2.gz	OXSJILZQLZJPSZ-UHFFFAOYSA-N	-2	1	382.463	2.716	20	0		GFADML
C[C@@H](CC(C)(C)[N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000777912381	656841839	/nfs/dbraw/zinc/84/18/39/656841839.db2.gz	RZQXRLTZOFLJJM-ZETCQYMHSA-N	-2	1	399.694	2.665	20	0		GFADML
COc1cnc([C@H]2CCCN2C(=O)c2cccc(Br)c2[O-])[n-]c1=O	ZINC000889789958	663267230	/nfs/dbraw/zinc/26/72/30/663267230.db2.gz	LJDYUZFBHPOGMG-LLVKDONJSA-N	-2	1	394.225	2.636	20	0		GFADML
O=C([O-])C[C@@H]1COCC[C@H]1[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000899948490	663703482	/nfs/dbraw/zinc/70/34/82/663703482.db2.gz	FPJRZWTXKPFNGQ-MWLCHTKSSA-N	-2	1	389.882	2.713	20	0		GFADML
CCOc1cc(C(=O)N2CC[C@@](C(=O)[O-])(C(F)(F)F)C2)cc(Cl)c1[O-]	ZINC000909758328	664173148	/nfs/dbraw/zinc/17/31/48/664173148.db2.gz	JUIJGMJMHHMBIN-CQSZACIVSA-N	-2	1	381.734	2.924	20	0		GFADML
O=C([N-]c1nnc([N-]S(=O)(=O)c2ccccc2)s1)c1ccc(Cl)o1	ZINC000121330893	551232370	/nfs/dbraw/zinc/23/23/70/551232370.db2.gz	HVRJCHQZLMWEBV-UHFFFAOYSA-N	-2	1	384.826	2.838	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1cccc(NC(N)=O)c1	ZINC000327153253	563457509	/nfs/dbraw/zinc/45/75/09/563457509.db2.gz	QBPJRQIPUYLQRU-UHFFFAOYSA-N	-2	1	383.813	2.638	20	0		GFADML
COCCOc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])cc1	ZINC000327376113	563458160	/nfs/dbraw/zinc/45/81/60/563458160.db2.gz	DPDPOCUSUIAFCW-UHFFFAOYSA-N	-2	1	385.825	2.864	20	0		GFADML
CCc1ccc(S(=O)(=O)[N-]c2cccc(C[S@](C)=O)c2)cc1C(=O)[O-]	ZINC000440823703	563751187	/nfs/dbraw/zinc/75/11/87/563751187.db2.gz	SDNPLSUDLJPGHA-DEOSSOPVSA-N	-2	1	381.475	2.627	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(F)c2)cc1Cl	ZINC000509628116	564307237	/nfs/dbraw/zinc/30/72/37/564307237.db2.gz	GFUADAFDPMNVMB-UHFFFAOYSA-N	-2	1	389.788	2.752	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(C(=O)[O-])cc1O	ZINC000476398402	564338036	/nfs/dbraw/zinc/33/80/36/564338036.db2.gz	FQEXRJRDEHWNAP-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
Cc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1cc(Cl)c(C)c(C(=O)[O-])c1	ZINC000479241473	564432654	/nfs/dbraw/zinc/43/26/54/564432654.db2.gz	NEYJAHFOGAAZKT-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cc(Cl)sc1Cl)Cc1cccnc1	ZINC000547568610	564495735	/nfs/dbraw/zinc/49/57/35/564495735.db2.gz	KGSDFAXYGSJULM-SECBINFHSA-N	-2	1	395.289	2.672	20	0		GFADML
CC(C)(C)[C@@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000548203643	564535985	/nfs/dbraw/zinc/53/59/85/564535985.db2.gz	STSIQIZQXIXYSN-ZETCQYMHSA-N	-2	1	390.708	2.942	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl)C(=O)[O-]	ZINC000484791734	564599235	/nfs/dbraw/zinc/59/92/35/564599235.db2.gz	XSHGGCDPDYBPRV-SCSAIBSYSA-N	-2	1	377.043	2.507	20	0		GFADML
C[C@@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl	ZINC000484581341	564590981	/nfs/dbraw/zinc/59/09/81/564590981.db2.gz	DWBNESRPNZJACK-YFKPBYRVSA-N	-2	1	391.070	2.897	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C)c2)cc1Cl	ZINC000484779359	564598309	/nfs/dbraw/zinc/59/83/09/564598309.db2.gz	AFCOMJCVLYBRAO-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc2c(C(=O)[O-])c[nH]c2c1	ZINC000521144325	564619714	/nfs/dbraw/zinc/61/97/14/564619714.db2.gz	FAJJJOVOVIEBEE-UHFFFAOYSA-N	-2	1	380.403	2.735	20	0		GFADML
O=C([O-])[C@@H](Cc1ccco1)[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl	ZINC000530541150	564887131	/nfs/dbraw/zinc/88/71/31/564887131.db2.gz	HTTZTQFQWBCWGZ-SECBINFHSA-N	-2	1	382.196	2.700	20	0		GFADML
CC(=O)c1ccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(Cl)c2)cc1	ZINC000500306156	564950392	/nfs/dbraw/zinc/95/03/92/564950392.db2.gz	RGSKXTJWYNGMTO-UHFFFAOYSA-N	-2	1	383.809	2.807	20	0		GFADML
O=C([O-])CCOc1ccc([N-]S(=O)(=O)c2ccc3ncsc3c2)cc1	ZINC000504523981	565041178	/nfs/dbraw/zinc/04/11/78/565041178.db2.gz	MLHQOAKFUINAQX-UHFFFAOYSA-N	-2	1	378.431	2.951	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)c1C	ZINC000609411319	566038824	/nfs/dbraw/zinc/03/88/24/566038824.db2.gz	WXHIIYDLBARJKU-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1[nH]c(=O)c(-c2nn[n-]n2)c(C)c1CCC(=O)Nc1cccc(Cl)c1[O-]	ZINC000737198468	599010527	/nfs/dbraw/zinc/01/05/27/599010527.db2.gz	ABJWQGPYCJEQBA-UHFFFAOYSA-N	-2	1	388.815	2.514	20	0		GFADML
O=C([O-])Cc1ccccc1[N-]S(=O)(=O)c1cc(C(=O)[O-])cc2c1CCCC2	ZINC000819626124	597313787	/nfs/dbraw/zinc/31/37/87/597313787.db2.gz	JNPKASIWICTXIW-UHFFFAOYSA-N	-3	1	389.429	2.692	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)c1C	ZINC000737713154	599908222	/nfs/dbraw/zinc/90/82/22/599908222.db2.gz	MHSUKSQKZPJCEH-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
Cc1cccc(C[C@@H](C[N-]S(=O)(=O)c2cc(F)c(F)cc2F)C(=O)[O-])c1	ZINC000548228505	600095506	/nfs/dbraw/zinc/09/55/06/600095506.db2.gz	JKJOPBKQGZPBRE-LBPRGKRZSA-N	-2	1	387.379	2.634	20	0		GFADML
CC(C)C(=O)Nc1cccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])c1	ZINC000736346881	600095692	/nfs/dbraw/zinc/09/56/92/600095692.db2.gz	BFJXUTKNXZJRLU-UHFFFAOYSA-N	-2	1	380.397	2.919	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1cccc(OC[C@@H]2CCCO2)c1	ZINC000740144333	600097031	/nfs/dbraw/zinc/09/70/31/600097031.db2.gz	MMUZOYCAROJSTD-HNNXBMFYSA-N	-2	1	395.408	2.883	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(-n2cccn2)c(F)c1	ZINC000740147166	600098157	/nfs/dbraw/zinc/09/81/57/600098157.db2.gz	ZPIOXGBACWHVTH-UHFFFAOYSA-N	-2	1	379.344	2.650	20	0		GFADML
CN(C(=O)CSc1nc(C(F)(F)F)cc(=O)[n-]1)c1ccccc1C(=O)[O-]	ZINC000737326347	600120334	/nfs/dbraw/zinc/12/03/34/600120334.db2.gz	XKWULIARZWXRFR-UHFFFAOYSA-N	-2	1	387.339	2.654	20	0		GFADML
O=C([O-])CN(Cc1ccc(F)c(F)c1)Cn1[n-]c(-c2ccccn2)nc1=S	ZINC000739795908	600313787	/nfs/dbraw/zinc/31/37/87/600313787.db2.gz	WQIMFBKIOZQGST-UHFFFAOYSA-N	-2	1	391.403	2.825	20	0		GFADML
O=C([O-])c1ccnc(NC(=O)c2cccc([N-]S(=O)(=O)c3ccccc3)c2)c1	ZINC000740245620	600435431	/nfs/dbraw/zinc/43/54/31/600435431.db2.gz	UJNGHNJTYADMOQ-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(N2CCCC2=O)c(F)c1	ZINC000740143146	600459384	/nfs/dbraw/zinc/45/93/84/600459384.db2.gz	DRQWSBDRVHYYSY-UHFFFAOYSA-N	-2	1	396.371	2.591	20	0		GFADML
CCC(=O)Nc1ccc(C)c([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)c1	ZINC000481972243	600627124	/nfs/dbraw/zinc/62/71/24/600627124.db2.gz	MEPHLAZAKLUPDQ-UHFFFAOYSA-N	-2	1	376.434	2.771	20	0		GFADML
CCOC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000737144800	600628076	/nfs/dbraw/zinc/62/80/76/600628076.db2.gz	SSURMKIRBYYART-UHFFFAOYSA-N	-2	1	392.433	2.707	20	0		GFADML
COCCOCc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000048382602	600811541	/nfs/dbraw/zinc/81/15/41/600811541.db2.gz	WTBPXNJSNKECHB-UHFFFAOYSA-N	-2	1	379.434	2.657	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000737124216	600889332	/nfs/dbraw/zinc/88/93/32/600889332.db2.gz	ZQSFEGKSHPVALZ-UHFFFAOYSA-N	-2	1	382.825	2.589	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(N(C)C(=O)[O-])cc2)cc1C	ZINC000737703449	600890619	/nfs/dbraw/zinc/89/06/19/600890619.db2.gz	XGAWIKYHOSTACL-UHFFFAOYSA-N	-2	1	378.406	2.697	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1CO	ZINC000737203367	600890736	/nfs/dbraw/zinc/89/07/36/600890736.db2.gz	LJCPXIJXWGHWKQ-UHFFFAOYSA-N	-2	1	385.825	2.730	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(-n3cncn3)c(F)c2)c1	ZINC000740076231	600891384	/nfs/dbraw/zinc/89/13/84/600891384.db2.gz	SPKWJGPKGDJNAY-UHFFFAOYSA-N	-2	1	396.787	2.559	20	0		GFADML
Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)cn2)n1	ZINC000738217642	601323514	/nfs/dbraw/zinc/32/35/14/601323514.db2.gz	FSNOQEMPPYPCPB-UHFFFAOYSA-N	-2	1	390.396	2.522	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c(C)c1	ZINC000829803827	601326323	/nfs/dbraw/zinc/32/63/23/601326323.db2.gz	KCIIFEAHIMJVJE-IZZDOVSWSA-N	-2	1	388.445	2.643	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2cccc(OCC(=O)[O-])c2)cc1Cl	ZINC000825913411	601474842	/nfs/dbraw/zinc/47/48/42/601474842.db2.gz	RZARCSOHSLJLCQ-UHFFFAOYSA-N	-2	1	398.824	2.563	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(O[C@H]3CCOC3)cc2)cc(F)c1F	ZINC000751143933	601484543	/nfs/dbraw/zinc/48/45/43/601484543.db2.gz	YVIYPNCFAKJMDQ-LBPRGKRZSA-N	-2	1	399.371	2.632	20	0		GFADML
CC[C@@H](NC(=O)c1cc(S(=O)(=O)[N-]c2cccc(C)c2)ccc1C)C(=O)[O-]	ZINC000263054971	601752840	/nfs/dbraw/zinc/75/28/40/601752840.db2.gz	XIGUOFDTBHQFTO-QGZVFWFLSA-N	-2	1	390.461	2.697	20	0		GFADML
NC(=O)c1cc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)ccc1Cl	ZINC000028258489	601826794	/nfs/dbraw/zinc/82/67/94/601826794.db2.gz	SIETUXUFBYXGFE-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)ccc1Cl	ZINC000831348525	601828826	/nfs/dbraw/zinc/82/88/26/601828826.db2.gz	YOEFSLNELZIODM-UHFFFAOYSA-N	-2	1	397.836	2.945	20	0		GFADML
O=C([O-])c1c[nH]c2cc([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])ccc12	ZINC000833294553	601861582	/nfs/dbraw/zinc/86/15/82/601861582.db2.gz	JRDPQCRHDANVAX-UHFFFAOYSA-N	-3	1	378.337	2.504	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000826127539	601862394	/nfs/dbraw/zinc/86/23/94/601862394.db2.gz	XLNFVCPRONSABN-UHFFFAOYSA-N	-3	1	381.381	2.687	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])oc1Br)c1nccs1	ZINC000096742947	602157677	/nfs/dbraw/zinc/15/76/77/602157677.db2.gz	DXUHYSFKJFAXLG-LURJTMIESA-N	-2	1	395.256	2.626	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccccc2-n2ccc(C)n2)cc1C(=O)[O-]	ZINC000366033969	602308621	/nfs/dbraw/zinc/30/86/21/602308621.db2.gz	PAMIWBAMAQCFPQ-UHFFFAOYSA-N	-2	1	387.417	2.688	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(CNC(=O)[O-])c2)cc1	ZINC000739361317	602655243	/nfs/dbraw/zinc/65/52/43/602655243.db2.gz	NYHOFNPIKIEWOZ-UHFFFAOYSA-N	-2	1	392.433	2.822	20	0		GFADML
O=C([O-])NCc1nc(C(=O)[N-]c2nnc(Cc3ccccc3)s2)cs1	ZINC000740685562	602695075	/nfs/dbraw/zinc/69/50/75/602695075.db2.gz	MEZNXJJWDBHLCO-UHFFFAOYSA-N	-2	1	375.435	2.605	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCCNc2ccc(C(F)(F)F)cn2)c([O-])c1	ZINC000740698080	602848005	/nfs/dbraw/zinc/84/80/05/602848005.db2.gz	KDBWWYIHZQGXIA-UHFFFAOYSA-N	-2	1	384.314	2.738	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)c([O-])c1	ZINC000740699329	602848204	/nfs/dbraw/zinc/84/82/04/602848204.db2.gz	ILRNMCSHVKLOLV-UHFFFAOYSA-N	-2	1	389.452	2.737	20	0		GFADML
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000738702711	602862845	/nfs/dbraw/zinc/86/28/45/602862845.db2.gz	KIGICJQCFLKZQQ-GFCCVEGCSA-N	-2	1	379.413	2.611	20	0		GFADML
COc1cc(F)ccc1N1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000739867722	602865640	/nfs/dbraw/zinc/86/56/40/602865640.db2.gz	SPFYRNFZSFMYPK-UHFFFAOYSA-N	-2	1	389.383	2.592	20	0		GFADML
C[C@@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1	ZINC000825448072	603402280	/nfs/dbraw/zinc/40/22/80/603402280.db2.gz	AYILITSBVBJGDZ-LLVKDONJSA-N	-2	1	388.401	2.922	20	0		GFADML
CCc1cc2c(COC(=O)[C@@H]3CCC[C@H](NC(=O)[O-])C3)cc(=O)oc2cc1[O-]	ZINC000827568475	603872939	/nfs/dbraw/zinc/87/29/39/603872939.db2.gz	BXQOQUPNYROWSW-OCCSQVGLSA-N	-2	1	389.404	2.931	20	0		GFADML
COc1cc(C)c(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])cc1OC	ZINC000829095616	604014232	/nfs/dbraw/zinc/01/42/32/604014232.db2.gz	VVVPMYSXIVHHDI-UHFFFAOYSA-N	-2	1	392.433	2.854	20	0		GFADML
Cc1nc(-c2ccc(NC[C@H]3[C@@H](C)OC(C)(C)N3C(=O)[O-])nc2)[n-]c(=O)c1C	ZINC000830685619	604019839	/nfs/dbraw/zinc/01/98/39/604019839.db2.gz	ITAVDOJXZQZBAM-OCCSQVGLSA-N	-2	1	387.440	2.776	20	0		GFADML
CCc1cc2c(COC(=O)CC3(NC(=O)[O-])CCC3)cc(=O)oc2cc1[O-]	ZINC000827568432	604234716	/nfs/dbraw/zinc/23/47/16/604234716.db2.gz	BCHALXUAXOMBKH-UHFFFAOYSA-N	-2	1	375.377	2.685	20	0		GFADML
Cc1ccc(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])c(O[C@H]2CCOC2)c1	ZINC000830316619	604297960	/nfs/dbraw/zinc/29/79/60/604297960.db2.gz	ABBZDVVZRRHQJT-HNNXBMFYSA-N	-2	1	386.404	2.888	20	0		GFADML
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C)c2)c1C	ZINC000476478811	604766569	/nfs/dbraw/zinc/76/65/69/604766569.db2.gz	CNVCNAJAKVZRHB-UHFFFAOYSA-N	-2	1	380.422	2.616	20	0		GFADML
CN1CCCc2ccc(S(=O)(=O)[N-]c3cccc(CNC(=O)[O-])c3)cc21	ZINC000828489318	604829016	/nfs/dbraw/zinc/82/90/16/604829016.db2.gz	SIVQPSKSPTVXCA-UHFFFAOYSA-N	-2	1	375.450	2.637	20	0		GFADML
CC(C)COC[C@@H]([N-]S(=O)(=O)c1cc(F)cc(C(=O)[O-])c1)c1ccco1	ZINC000833487740	605200010	/nfs/dbraw/zinc/20/00/10/605200010.db2.gz	GQKWGHKHRDZJCK-OAHLLOKOSA-N	-2	1	385.413	2.809	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])c(F)c2)cc1NC(C)=O	ZINC000833734472	605265571	/nfs/dbraw/zinc/26/55/71/605265571.db2.gz	GLLXDCQMHZPREY-UHFFFAOYSA-N	-2	1	397.384	2.683	20	0		GFADML
O=C([O-])N[C@@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccccc1	ZINC000834149824	605402313	/nfs/dbraw/zinc/40/23/13/605402313.db2.gz	JBIBGFIMDIXGQJ-NSHDSACASA-N	-2	1	390.248	2.676	20	0		GFADML
Cc1cc(Br)c([O-])c(NC(=O)CN(C[C@H]2CCCO2)C(=O)[O-])c1	ZINC000833899195	605472379	/nfs/dbraw/zinc/47/23/79/605472379.db2.gz	ZTKDDCDSPAUEOT-SNVBAGLBSA-N	-2	1	387.230	2.561	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccncc3)c2)c([O-])c1	ZINC000834255858	605646577	/nfs/dbraw/zinc/64/65/77/605646577.db2.gz	KQLSUUZWBASQTL-UHFFFAOYSA-N	-2	1	392.371	2.804	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2C[C@H](O)C[C@H]2c2ccc(F)c(F)c2)c([O-])c1	ZINC000834256949	605662244	/nfs/dbraw/zinc/66/22/44/605662244.db2.gz	PSHKELUPZQUXIV-ABAIWWIYSA-N	-2	1	378.331	2.708	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2cccc(SC)c2)cc(C(=O)[O-])c1OC	ZINC000045946810	654672599	/nfs/dbraw/zinc/67/25/99/654672599.db2.gz	CEQDLVLOMLMLTO-UHFFFAOYSA-N	-2	1	383.447	2.925	20	0		GFADML
O=C(N[N-]S(=O)(=O)c1cc(Cl)ccc1Cl)c1ccc(Cl)cc1[O-]	ZINC000055665121	654780127	/nfs/dbraw/zinc/78/01/27/654780127.db2.gz	MKBHGLWBJOACJJ-UHFFFAOYSA-N	-2	1	395.651	2.976	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)COC3)ccc1Br	ZINC000324237321	655384086	/nfs/dbraw/zinc/38/40/86/655384086.db2.gz	GECSMFVAMOKCOK-UHFFFAOYSA-N	-2	1	398.234	2.978	20	0		GFADML
C[C@H](CC(F)(F)F)[N-]S(=O)(=O)c1cc(C(=O)[O-])sc1Br	ZINC000235458385	655424476	/nfs/dbraw/zinc/42/44/76/655424476.db2.gz	AJKWOYCUFAONBZ-SCSAIBSYSA-N	-2	1	396.206	2.828	20	0		GFADML
C[C@]1(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)CC1(Cl)Cl	ZINC000840894386	661201594	/nfs/dbraw/zinc/20/15/94/661201594.db2.gz	SFDUXQPTCILLJF-LBPRGKRZSA-N	-2	1	388.219	2.915	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2c(c1)C(=O)OC2	ZINC000762618664	656051615	/nfs/dbraw/zinc/05/16/15/656051615.db2.gz	UWZNKUUNPJCBTD-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
C[C@@H](CCCCC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000776554584	656757347	/nfs/dbraw/zinc/75/73/47/656757347.db2.gz	HIEWREMIHMKHIL-QMMMGPOBSA-N	-2	1	399.694	2.809	20	0		GFADML
O=C([O-])[C@@H](Cc1ccc(F)cc1)[N-]S(=O)(=O)c1c(Cl)ccnc1Cl	ZINC000776621870	656769040	/nfs/dbraw/zinc/76/90/40/656769040.db2.gz	GUVMABKVJUBEQJ-LLVKDONJSA-N	-2	1	393.223	2.502	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1cccc2c1COC2=O	ZINC000808127670	659879544	/nfs/dbraw/zinc/87/95/44/659879544.db2.gz	OXKDJXNCCQKBSX-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
O=C([O-])C1=CC[C@@H]([N-]S(=O)(=O)c2cc(Cl)c(Br)cc2F)C1	ZINC000853068809	661880446	/nfs/dbraw/zinc/88/04/46/661880446.db2.gz	FHLJJNWUKCBRAI-SSDOTTSWSA-N	-2	1	398.637	2.693	20	0		GFADML
O=C([O-])c1cc(Br)c(S(=O)(=O)[N-][C@H]2CCC(F)(F)C2)s1	ZINC000871921850	662742055	/nfs/dbraw/zinc/74/20/55/662742055.db2.gz	SPPDCKSKZVAKJF-YFKPBYRVSA-N	-2	1	390.227	2.675	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)CCS2	ZINC000899949105	663703684	/nfs/dbraw/zinc/70/36/84/663703684.db2.gz	LWJFKKFNVFCLEA-VOZQYIJBSA-N	-2	1	393.889	2.886	20	0		GFADML
Cc1cc(Cl)ccc1CN1CCC[C@@H]([N-]C(=O)C(F)(F)F)[C@@H]1C(=O)[O-]	ZINC000903707175	663804597	/nfs/dbraw/zinc/80/45/97/663804597.db2.gz	SHZWTZVDDLGGJX-CHWSQXEVSA-N	-2	1	378.778	2.745	20	0		GFADML
CC[C@@H](CCC(=O)[O-])[N-]S(=O)(=O)c1c(Br)ccc(OC)c1F	ZINC000903845104	663808592	/nfs/dbraw/zinc/80/85/92/663808592.db2.gz	GUZHJUNQEDAFJC-QMMMGPOBSA-N	-2	1	398.250	2.519	20	0		GFADML
COc1cccc(S(=O)(=O)[N-]c2ccc(Br)c(C(=O)[O-])c2)c1	ZINC000388491091	563520529	/nfs/dbraw/zinc/52/05/29/563520529.db2.gz	MHUHLEFTXOJEKM-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
CCn1cc(S(=O)(=O)[N-]c2ccc(F)c(Br)c2)cc1C(=O)[O-]	ZINC000388567416	563521131	/nfs/dbraw/zinc/52/11/31/563521131.db2.gz	MUVGMPHNHRKDSO-UHFFFAOYSA-N	-2	1	391.218	2.909	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2F)c1Cl	ZINC000431180598	563555764	/nfs/dbraw/zinc/55/57/64/563555764.db2.gz	PKGUPOFGRHTRRZ-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1ccc([O-])c(S(=O)(=O)Nc2ccc(CC(F)(F)F)cc2)c1	ZINC000436993989	563687524	/nfs/dbraw/zinc/68/75/24/563687524.db2.gz	JRLYOTAJMMHOIR-UHFFFAOYSA-N	-2	1	375.324	2.996	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)c(Cl)cn2)ccc1[O-]	ZINC000437337302	563693893	/nfs/dbraw/zinc/69/38/93/563693893.db2.gz	NKWKZUOJVCOLOH-UHFFFAOYSA-N	-2	1	377.205	2.681	20	0		GFADML
C[S@](=O)Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000438772158	563710144	/nfs/dbraw/zinc/71/01/44/563710144.db2.gz	DKRYPMFOLQZEJI-QHCPKHFHSA-N	-2	1	387.866	2.718	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCC[C@H]1CF	ZINC000293952135	563828251	/nfs/dbraw/zinc/82/82/51/563828251.db2.gz	DMOOMASVSIERAN-LBPRGKRZSA-N	-2	1	384.454	2.829	20	0		GFADML
Cc1noc(C(C)(C)[N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C(C)(C)C)n1	ZINC000565836433	564299020	/nfs/dbraw/zinc/29/90/20/564299020.db2.gz	CLQJWZSZQOLSDK-UHFFFAOYSA-N	-2	1	387.483	2.649	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3c[nH]nc3c2)cc1Br	ZINC000476272016	564332131	/nfs/dbraw/zinc/33/21/31/564332131.db2.gz	DRRHUCKWGVWJPE-UHFFFAOYSA-N	-2	1	396.222	2.824	20	0		GFADML
CCc1ccc(S(=O)(=O)[N-]c2ccccc2C[S@@](C)=O)cc1C(=O)[O-]	ZINC000546538487	564457879	/nfs/dbraw/zinc/45/78/79/564457879.db2.gz	KAMXHBWTKDVLOE-XMMPIXPASA-N	-2	1	381.475	2.627	20	0		GFADML
Cc1cc(C(=O)N2CCc3sc(Cl)cc3C2)[n-]c2nc(=O)[n-]c(=O)c1-2	ZINC000514940781	564463808	/nfs/dbraw/zinc/46/38/08/564463808.db2.gz	WSZYZLLMQGMYBI-UHFFFAOYSA-N	-2	1	376.825	2.658	20	0		GFADML
CC(C)(C[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000547565706	564495075	/nfs/dbraw/zinc/49/50/75/564495075.db2.gz	OZTVMYCHVWLHJC-UHFFFAOYSA-N	-2	1	376.681	2.553	20	0		GFADML
Cc1ccc(F)c([N-]S(=O)(=O)c2cncc(Br)c2)c1C(=O)[O-]	ZINC000547602340	564501763	/nfs/dbraw/zinc/50/17/63/564501763.db2.gz	RZZUWFNEPHUBDL-UHFFFAOYSA-N	-2	1	389.202	2.791	20	0		GFADML
O=C([O-])[C@@H](Cc1c(F)cccc1Cl)[N-]S(=O)(=O)c1cc(F)ccc1F	ZINC000547613086	564503240	/nfs/dbraw/zinc/50/32/40/564503240.db2.gz	MCFNVNCRXSEBQA-CYBMUJFWSA-N	-2	1	393.770	2.732	20	0		GFADML
O=C([O-])[C@H]1CCCCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000547934789	564523862	/nfs/dbraw/zinc/52/38/62/564523862.db2.gz	JBYUSZPGNXIPDL-UWVGGRQHSA-N	-2	1	380.260	2.744	20	0		GFADML
O=C([O-])C1(C[N-]S(=O)(=O)c2cc(Br)sc2Cl)CCC1	ZINC000551911723	564667714	/nfs/dbraw/zinc/66/77/14/564667714.db2.gz	ONAOTGBKWPIDBO-UHFFFAOYSA-N	-2	1	388.692	2.697	20	0		GFADML
O=S(=O)([N-]c1ccnn1C1CCCC1)c1cccc(Cl)c1-c1nn[n-]n1	ZINC000738339690	598867510	/nfs/dbraw/zinc/86/75/10/598867510.db2.gz	PKROWOSQSJUPGF-UHFFFAOYSA-N	-2	1	393.860	2.633	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(C(=O)NC[C@@H](C)C(=O)[O-])ccc2C)c1	ZINC000262485042	599775496	/nfs/dbraw/zinc/77/54/96/599775496.db2.gz	FFAUYARREYQSAZ-CQSZACIVSA-N	-2	1	390.461	2.555	20	0		GFADML
CCc1cc2c(COC(=O)c3ccc(OCC(=O)[O-])cc3)cc(=O)oc2cc1[O-]	ZINC000737252363	599882384	/nfs/dbraw/zinc/88/23/84/599882384.db2.gz	NJPSAHPCBXSLGF-UHFFFAOYSA-N	-2	1	398.367	2.881	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])cc1C(=O)NC(C)C	ZINC000738635841	599908769	/nfs/dbraw/zinc/90/87/69/599908769.db2.gz	GQTMLDHLJABUHM-UHFFFAOYSA-N	-2	1	376.434	2.632	20	0		GFADML
Cc1cnc(-c2cccc([N-]S(=O)(=O)c3ccc(OCC(=O)[O-])cc3)c2)o1	ZINC000066814611	599974240	/nfs/dbraw/zinc/97/42/40/599974240.db2.gz	WDVVDWVYVZZFDH-UHFFFAOYSA-N	-2	1	388.401	2.914	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(F)c(NC(=O)[O-])c1	ZINC000738291606	600100769	/nfs/dbraw/zinc/10/07/69/600100769.db2.gz	VZFMYHOSPWLZKA-UHFFFAOYSA-N	-3	1	386.332	2.862	20	0		GFADML
O=C([O-])Nc1cc([N-]S(=O)(=O)c2ccc3oc(=O)ccc3c2)ccc1F	ZINC000740013433	600101640	/nfs/dbraw/zinc/10/16/40/600101640.db2.gz	YCLGVULBDKGMOQ-UHFFFAOYSA-N	-2	1	378.337	2.823	20	0		GFADML
CN(C)c1nc2sc(C(=O)[N-]c3nnc(CCC(=O)[O-])s3)cc2s1	ZINC000737385754	600205149	/nfs/dbraw/zinc/20/51/49/600205149.db2.gz	JOWUDNZCLLYLCH-UHFFFAOYSA-N	-2	1	383.480	2.545	20	0		GFADML
CCOC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)c1	ZINC000737155137	600299738	/nfs/dbraw/zinc/29/97/38/600299738.db2.gz	JPFYONCUVJPAQN-UHFFFAOYSA-N	-2	1	392.433	2.774	20	0		GFADML
CN(Cc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)cc1)C(=O)[O-]	ZINC000737485752	600299759	/nfs/dbraw/zinc/29/97/59/600299759.db2.gz	DUMOWUAXYMZFBZ-UHFFFAOYSA-N	-2	1	398.824	2.949	20	0		GFADML
COc1ccc(C(=O)Nc2cccc(C(=O)N3CCCC[C@H]3C(=O)[O-])c2)c([O-])c1	ZINC000621999835	600485423	/nfs/dbraw/zinc/48/54/23/600485423.db2.gz	VCKDJOAEZUTVQW-KRWDZBQOSA-N	-2	1	398.415	2.732	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)c1	ZINC000736064899	600638003	/nfs/dbraw/zinc/63/80/03/600638003.db2.gz	UUXKUTVFOJFBQB-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(OCC(=O)[O-])cc2)cc1	ZINC000826668985	600675869	/nfs/dbraw/zinc/67/58/69/600675869.db2.gz	AGKBDJOLBQVHIK-UHFFFAOYSA-N	-2	1	377.418	2.790	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2ccc(N3CCCCCC3)cc2)cc1C(=O)[O-]	ZINC000833055512	600830453	/nfs/dbraw/zinc/83/04/53/600830453.db2.gz	KYMVICPVMRCZGW-UHFFFAOYSA-N	-2	1	377.466	2.905	20	0		GFADML
C[C@@H]1Oc2ccc([N-]S(=O)(=O)c3cc(Cl)cc(C(=O)[O-])c3)cc2NC1=O	ZINC000736832649	600888257	/nfs/dbraw/zinc/88/82/57/600888257.db2.gz	APJNXHJYVDKQCC-QMMMGPOBSA-N	-2	1	396.808	2.558	20	0		GFADML
COCCOCc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)c1	ZINC000671658372	600890678	/nfs/dbraw/zinc/89/06/78/600890678.db2.gz	WOYZYGAOXLQKFE-UHFFFAOYSA-N	-2	1	379.434	2.657	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(-c3nc[nH]n3)cc2)c1	ZINC000740075287	600893705	/nfs/dbraw/zinc/89/37/05/600893705.db2.gz	IEPHNHAANJNRMP-UHFFFAOYSA-N	-2	1	378.797	2.624	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(-c3nc[nH]n3)c2)c1	ZINC000740075777	600894893	/nfs/dbraw/zinc/89/48/93/600894893.db2.gz	OXWIDZJIWBYAPI-UHFFFAOYSA-N	-2	1	378.797	2.624	20	0		GFADML
COC(=O)C(C)(C)c1ccc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])cc1	ZINC000737560408	600899352	/nfs/dbraw/zinc/89/93/52/600899352.db2.gz	AWURUWHSNVXBQY-UHFFFAOYSA-N	-2	1	391.445	2.945	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)[C@H]1c1ccccc1	ZINC000828394948	600936913	/nfs/dbraw/zinc/93/69/13/600936913.db2.gz	URKPEEDVGAHENC-SPLOXXLWSA-N	-2	1	391.427	2.626	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(N3CCCC3)nc2)c1	ZINC000833297934	600979702	/nfs/dbraw/zinc/97/97/02/600979702.db2.gz	YDRADDOKLKJUFB-UHFFFAOYSA-N	-2	1	381.841	2.834	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NC[C@H](Cc1cccc(F)c1)C(=O)[O-]	ZINC000431653550	601282974	/nfs/dbraw/zinc/28/29/74/601282974.db2.gz	KVEVUVODCQFZQG-ZDUSSCGKSA-N	-2	1	389.427	2.601	20	0		GFADML
COC(=O)/C=C\c1ccc(S(=O)(=O)[N-]c2ccc(C)cc2C(=O)[O-])cc1	ZINC000747608215	601324250	/nfs/dbraw/zinc/32/42/50/601324250.db2.gz	FTOCLIAFUJXDPF-POHAHGRESA-N	-2	1	375.402	2.680	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccc(/C=C/C(=O)[O-])cc3)c2)no1	ZINC000832991832	601327901	/nfs/dbraw/zinc/32/79/01/601327901.db2.gz	RZZDSBWAKBDJON-JXMROGBWSA-N	-2	1	385.401	2.944	20	0		GFADML
COC(=O)/C=C/c1ccc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)cc1	ZINC000831125177	601330351	/nfs/dbraw/zinc/33/03/51/601330351.db2.gz	YRUPOAVLATVITH-NTUHNPAUSA-N	-2	1	389.429	2.691	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)ccc1C(=O)N(C)C	ZINC000832899894	601332921	/nfs/dbraw/zinc/33/29/21/601332921.db2.gz	UPJPGSZXLJUTQA-IZZDOVSWSA-N	-2	1	388.445	2.595	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@@H](c2ccccc2)[C@H](C)C(=O)[O-])c(=O)[n-]1	ZINC000832794190	601392306	/nfs/dbraw/zinc/39/23/06/601392306.db2.gz	DXBQZRANMSFZEX-MEDUHNTESA-N	-2	1	389.477	2.723	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cccc(C(=O)NCC(C)(C)C(=O)[O-])c2)c1	ZINC000262152771	601707634	/nfs/dbraw/zinc/70/76/34/601707634.db2.gz	AZBWWEMHMQRFPK-UHFFFAOYSA-N	-2	1	390.461	2.636	20	0		GFADML
CCNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000392249820	601827458	/nfs/dbraw/zinc/82/74/58/601827458.db2.gz	UTMWKSHXOLKRMA-UHFFFAOYSA-N	-2	1	382.825	2.589	20	0		GFADML
CC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1C	ZINC000751147952	601833365	/nfs/dbraw/zinc/83/33/65/601833365.db2.gz	YOMNRTRISGSFHL-UHFFFAOYSA-N	-2	1	384.360	2.731	20	0		GFADML
CCn1cnnc1-c1cccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])c1	ZINC000830435163	601857820	/nfs/dbraw/zinc/85/78/20/601857820.db2.gz	LONOZBNODVXPNC-UHFFFAOYSA-N	-2	1	390.396	2.603	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])ccc1C(=O)NC(C)C	ZINC000832900015	601861599	/nfs/dbraw/zinc/86/15/99/601861599.db2.gz	XSTYBGLCWVDFSJ-UHFFFAOYSA-N	-2	1	394.424	2.771	20	0		GFADML
O=C([O-])c1nscc1S(=O)(=O)[N-]c1cc(F)ccc1Br	ZINC000833344873	601864865	/nfs/dbraw/zinc/86/48/65/601864865.db2.gz	FWJNDPDQANELQB-UHFFFAOYSA-N	-2	1	381.204	2.544	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)OCc1ccc(C(=O)[O-])s1	ZINC000829545831	602005173	/nfs/dbraw/zinc/00/51/73/602005173.db2.gz	PKPGHAVCSQWJHF-UHFFFAOYSA-N	-2	1	383.447	2.955	20	0		GFADML
CCCc1cc([N-]S(=O)(=O)c2ccc(Br)cc2C(=O)[O-])[nH]n1	ZINC000829567042	602306236	/nfs/dbraw/zinc/30/62/36/602306236.db2.gz	WJYMIXKXEQEMBX-UHFFFAOYSA-N	-2	1	388.243	2.624	20	0		GFADML
CCC[C@H](NC(=O)[O-])C(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000739324205	602396897	/nfs/dbraw/zinc/39/68/97/602396897.db2.gz	ZBHVFDSWSHMQGJ-INIZCTEOSA-N	-2	1	391.449	2.862	20	0		GFADML
CCc1cc2c(COC(=O)[C@@H]3CCCCN3C(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000739541309	602554979	/nfs/dbraw/zinc/55/49/79/602554979.db2.gz	BHBPJHJHSPJWAY-AWEZNQCLSA-N	-2	1	375.377	2.637	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)CCCN2C(=O)[O-]	ZINC000740278452	602646375	/nfs/dbraw/zinc/64/63/75/602646375.db2.gz	BTMXLWPEDJHYNR-UHFFFAOYSA-N	-3	1	396.446	2.986	20	0		GFADML
COCCc1ccc(S(=O)(=O)[N-]c2ccccc2CN(C)C(=O)[O-])cc1	ZINC000739838183	602654752	/nfs/dbraw/zinc/65/47/52/602654752.db2.gz	QWNAAHZICIWJIH-UHFFFAOYSA-N	-2	1	378.450	2.786	20	0		GFADML
Cc1ccc(Cc2nnc([N-]C(=O)c3csc(CNC(=O)[O-])n3)s2)cc1	ZINC000740131805	602704871	/nfs/dbraw/zinc/70/48/71/602704871.db2.gz	ICDAYXSGUIHPPZ-UHFFFAOYSA-N	-2	1	389.462	2.914	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C[C@H](C)N1C(=O)OC(C)(C)C	ZINC000739169506	602864212	/nfs/dbraw/zinc/86/42/12/602864212.db2.gz	QDPSSRWAVDBOCA-TXEJJXNPSA-N	-2	1	393.440	2.952	20	0		GFADML
COCC[S@](=O)Cc1cccc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])c1	ZINC000739837663	602867280	/nfs/dbraw/zinc/86/72/80/602867280.db2.gz	OMIRXFFNFVIGST-MHZLTWQESA-N	-2	1	392.433	2.630	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])CC[C@@H]1NC(=O)[O-]	ZINC000739164389	602868897	/nfs/dbraw/zinc/86/88/97/602868897.db2.gz	CPQGHWYSRYGEJK-FZMZJTMJSA-N	-2	1	393.440	2.857	20	0		GFADML
Cc1ccc(NC(=O)C[C@H](C)NC(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1	ZINC000830364052	603330409	/nfs/dbraw/zinc/33/04/09/603330409.db2.gz	LVUHBBQIHJMMBA-ZDUSSCGKSA-N	-2	1	391.449	2.781	20	0		GFADML
C[C@@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCCO3)cc1	ZINC000825448928	603402185	/nfs/dbraw/zinc/40/21/85/603402185.db2.gz	HZLXUHGFIWUFMN-LLVKDONJSA-N	-2	1	378.406	2.587	20	0		GFADML
C[C@@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)cc1	ZINC000825449459	603493355	/nfs/dbraw/zinc/49/33/55/603493355.db2.gz	QSVDILRSQYYCCQ-LLVKDONJSA-N	-2	1	387.417	2.658	20	0		GFADML
CCc1cc2c(COC(=O)[C@@H]3CC[C@H](NC(=O)[O-])C3)cc(=O)oc2cc1[O-]	ZINC000827571125	604056164	/nfs/dbraw/zinc/05/61/64/604056164.db2.gz	XHWMELRNWZLJSE-YPMHNXCESA-N	-2	1	375.377	2.541	20	0		GFADML
CCc1cc2c(COC(=O)[C@@H]3CC[C@@H](NC(=O)[O-])C3)cc(=O)oc2cc1[O-]	ZINC000827571123	604056407	/nfs/dbraw/zinc/05/64/07/604056407.db2.gz	XHWMELRNWZLJSE-DGCLKSJQSA-N	-2	1	375.377	2.541	20	0		GFADML
COc1ccccc1[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])c(C)o1)c1ccco1	ZINC000832597512	604363675	/nfs/dbraw/zinc/36/36/75/604363675.db2.gz	YZNSLJRVIPSIDT-QGZVFWFLSA-N	-2	1	391.401	2.956	20	0		GFADML
COc1ccccc1[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])c(C)o1)c1ccco1	ZINC000832597507	604364115	/nfs/dbraw/zinc/36/41/15/604364115.db2.gz	YZNSLJRVIPSIDT-KRWDZBQOSA-N	-2	1	391.401	2.956	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)[O-]	ZINC000833004332	604375810	/nfs/dbraw/zinc/37/58/10/604375810.db2.gz	NGPXIPLNFWLAQZ-IBGZPJMESA-N	-2	1	396.447	2.563	20	0		GFADML
O=C([O-])COc1ccc([N-]S(=O)(=O)c2cc(F)cc(F)c2)cc1Cl	ZINC000833259178	604807324	/nfs/dbraw/zinc/80/73/24/604807324.db2.gz	LRDSFPHIBAFQAH-UHFFFAOYSA-N	-2	1	377.752	2.882	20	0		GFADML
O=C([O-])N[C@H](C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)c1ccccc1	ZINC000832789479	605791608	/nfs/dbraw/zinc/79/16/08/605791608.db2.gz	NKKUCLQDJFWWRJ-SFHVURJKSA-N	-2	1	382.416	2.822	20	0		GFADML
O=C([O-])N[C@@H](C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1)c1ccccc1	ZINC000832752129	605791931	/nfs/dbraw/zinc/79/19/31/605791931.db2.gz	NKKUCLQDJFWWRJ-GOSISDBHSA-N	-2	1	382.416	2.822	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2cc(C)c(C(=O)[O-])s2)c(F)cc1F	ZINC000066306485	654900404	/nfs/dbraw/zinc/90/04/04/654900404.db2.gz	CZKMCTIUOZWJGT-UHFFFAOYSA-N	-2	1	390.389	2.792	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2c(C)n[nH]c2C(F)F)cc1C(=O)[O-]	ZINC000272367556	655110338	/nfs/dbraw/zinc/11/03/38/655110338.db2.gz	ATQQAVBVVSNORG-UHFFFAOYSA-N	-2	1	375.353	2.553	20	0		GFADML
COC[C@@H]([N-]S(=O)(=O)c1cc(F)c(Cl)c(C(=O)[O-])c1)c1ccc(C)o1	ZINC000273630023	655151427	/nfs/dbraw/zinc/15/14/27/655151427.db2.gz	CJNGMZHHLNCHCX-GFCCVEGCSA-N	-2	1	391.804	2.745	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2cc(Br)cc(C(=O)[O-])c2N)cc1	ZINC000577364323	655457695	/nfs/dbraw/zinc/45/76/95/655457695.db2.gz	RILLVYSQWRRCBJ-UHFFFAOYSA-N	-2	1	385.239	2.839	20	0		GFADML
COc1cc(C)c([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1F	ZINC000775294222	656624784	/nfs/dbraw/zinc/62/47/84/656624784.db2.gz	LHRDVTMFTPQGHS-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
O=C([O-])Cc1ccc([N-]S(=O)(=O)c2ccc3nc(Cl)cnc3c2)cc1	ZINC000776443676	656741980	/nfs/dbraw/zinc/74/19/80/656741980.db2.gz	HLQHXJNKLPSKQH-UHFFFAOYSA-N	-2	1	377.809	2.711	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]C[C@@H](CC2CCCC2)C(=O)[O-])c(F)c1	ZINC000776556345	656757107	/nfs/dbraw/zinc/75/71/07/656757107.db2.gz	YYOBJWUJNQPSKT-LLVKDONJSA-N	-2	1	377.409	2.533	20	0		GFADML
CC(C)=CCSC[C@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)C(=O)[O-]	ZINC000776565211	656759195	/nfs/dbraw/zinc/75/91/95/656759195.db2.gz	YJCMYPAPMVEQNT-JTQLQIEISA-N	-2	1	399.321	2.819	20	0		GFADML
CC(C)(C)[C@@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000776571410	656760110	/nfs/dbraw/zinc/76/01/10/656760110.db2.gz	OXZOUVFVRRQJEF-SECBINFHSA-N	-2	1	399.694	2.665	20	0		GFADML
COc1ccc(Cl)cc1S(=O)(=O)[N-]N=c1c(F)c(F)[n-]c(F)c1F	ZINC000782460749	657146079	/nfs/dbraw/zinc/14/60/79/657146079.db2.gz	CBMMCMSKMPUSKJ-UHFFFAOYSA-N	-2	1	385.726	2.605	20	0		GFADML
O=C(Nc1nc(Br)ccc1[O-])c1[n-]cnc1C(=O)c1ccccc1	ZINC000790046485	657919082	/nfs/dbraw/zinc/91/90/82/657919082.db2.gz	GLOQVTCNKHJEJK-UHFFFAOYSA-N	-2	1	387.193	2.756	20	0		GFADML
C[C@@H]1C[C@@H](CC[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)C[C@H](C)O1	ZINC000802722531	659495708	/nfs/dbraw/zinc/49/57/08/659495708.db2.gz	BESZIMXWIMFWDV-JGPRNRPPSA-N	-2	1	377.409	2.535	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc2c(c1)C(=O)OC2	ZINC000808123887	659878993	/nfs/dbraw/zinc/87/89/93/659878993.db2.gz	IOSOOZALMNDHOH-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
O=C([O-])c1cc(Br)c(S(=O)(=O)[N-]CC[C@@H]2CC2(F)F)s1	ZINC000871993617	662750059	/nfs/dbraw/zinc/75/00/59/662750059.db2.gz	PHAZFXIJPFDHJQ-RXMQYKEDSA-N	-2	1	390.227	2.532	20	0		GFADML
O=C(NCc1ccoc1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000193371283	552991739	/nfs/dbraw/zinc/99/17/39/552991739.db2.gz	VUVCOSGIZGZNBJ-UHFFFAOYSA-N	-2	1	378.431	2.778	20	0		GFADML
O=C([O-])C1CCC([N-]S(=O)(=O)c2cc(Br)c(F)cc2F)CC1	ZINC000262485962	553171486	/nfs/dbraw/zinc/17/14/86/553171486.db2.gz	WPSVUUUFIXMVQG-UHFFFAOYSA-N	-2	1	398.225	2.649	20	0		GFADML
Cc1nc(C[N-]S(=O)(=O)c2c(Cl)cccc2Cl)sc1C(=O)[O-]	ZINC000316175353	563441659	/nfs/dbraw/zinc/44/16/59/563441659.db2.gz	ZBHFRWVLINNUFK-UHFFFAOYSA-N	-2	1	381.262	2.935	20	0		GFADML
O=C([O-])c1csc(C[N-]S(=O)(=O)c2ccc(Cl)c(F)c2Cl)n1	ZINC000318122259	563443266	/nfs/dbraw/zinc/44/32/66/563443266.db2.gz	ZICICCPYZDAVGF-UHFFFAOYSA-N	-2	1	385.225	2.766	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCO3)c(Br)c1	ZINC000319697676	563445592	/nfs/dbraw/zinc/44/55/92/563445592.db2.gz	XJLSLSXIPLFAOY-UHFFFAOYSA-N	-2	1	398.234	2.883	20	0		GFADML
CN(C)C(=O)c1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000327664425	563459535	/nfs/dbraw/zinc/45/95/35/563459535.db2.gz	IIYVGXCXRSYGHW-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cccc(Br)c2)c(C(=O)[O-])c1	ZINC000387522761	563519546	/nfs/dbraw/zinc/51/95/46/563519546.db2.gz	QIDGCFXGSHWWKW-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)ccc1Br	ZINC000388467302	563520715	/nfs/dbraw/zinc/52/07/15/563520715.db2.gz	LEOMFFRNHBMFCH-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COCCOCc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)c1	ZINC000393117160	563528521	/nfs/dbraw/zinc/52/85/21/563528521.db2.gz	YIQHXJOTIAZTPE-UHFFFAOYSA-N	-2	1	385.463	2.719	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(O)c1	ZINC000436743357	563678781	/nfs/dbraw/zinc/67/87/81/563678781.db2.gz	GPYXHTXAUMCLSD-UHFFFAOYSA-N	-3	1	385.781	2.551	20	0		GFADML
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2cccc(Cl)c2C(=O)[O-])c1	ZINC000436953542	563685833	/nfs/dbraw/zinc/68/58/33/563685833.db2.gz	QMYOCSWYPJSYCM-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl)C(=O)[O-]	ZINC000565473640	564282322	/nfs/dbraw/zinc/28/23/22/564282322.db2.gz	UWMSKDCPGDFIAL-ZCFIWIBFSA-N	-2	1	391.070	2.897	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2ccc(F)c(Cl)c2)cc1F	ZINC000509629607	564307166	/nfs/dbraw/zinc/30/71/66/564307166.db2.gz	WADBQHRKWCKJDS-UHFFFAOYSA-N	-2	1	377.752	2.882	20	0		GFADML
CC[C@H](CC[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000568726619	564431533	/nfs/dbraw/zinc/43/15/33/564431533.db2.gz	PCIKBYRDOYLSBZ-ZCFIWIBFSA-N	-2	1	390.708	2.943	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)c(C)c(C(=O)[O-])c2)c1	ZINC000479240368	564432809	/nfs/dbraw/zinc/43/28/09/564432809.db2.gz	HDQDSVRNWUTNSU-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1c(F)cc(C[N-]S(=O)(=O)c2c(F)cc(F)cc2F)cc1F	ZINC000569061825	564447325	/nfs/dbraw/zinc/44/73/25/564447325.db2.gz	FLQQNGFIWGISGK-UHFFFAOYSA-N	-2	1	381.278	2.559	20	0		GFADML
CCc1ccc([C@H](COC)[N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)o1	ZINC000517138149	564525112	/nfs/dbraw/zinc/52/51/12/564525112.db2.gz	XQCOGGLSRSNWOB-AWEZNQCLSA-N	-2	1	387.841	2.860	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1ccc(Br)o1)c1ccccc1	ZINC000548266841	564545591	/nfs/dbraw/zinc/54/55/91/564545591.db2.gz	IYLGUMPPPVJERU-LLVKDONJSA-N	-2	1	388.239	2.579	20	0		GFADML
NC(=O)c1cccc(S(=O)(=O)[N-]c2cc(Cl)c(Cl)c(C(=O)[O-])c2)c1	ZINC000485020001	564605078	/nfs/dbraw/zinc/60/50/78/564605078.db2.gz	BCTODMUBALAGSN-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)ccc1Cl	ZINC000485261085	564612050	/nfs/dbraw/zinc/61/20/50/564612050.db2.gz	NCGZPZKQAXMPNW-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
Cc1nc(C2([N-]S(=O)(=O)c3csc(C(=O)[O-])c3)CCCCCC2)no1	ZINC000556220598	564815371	/nfs/dbraw/zinc/81/53/71/564815371.db2.gz	ACSCSVQDMJDZDM-UHFFFAOYSA-N	-2	1	385.467	2.666	20	0		GFADML
CSCC[C@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Cl)C(=O)[O-]	ZINC000582185005	564834418	/nfs/dbraw/zinc/83/44/18/564834418.db2.gz	ULFXGVWXHIZXHA-VIFPVBQESA-N	-2	1	376.258	2.617	20	0		GFADML
COc1ccccc1[C@H](CC(C)C)[N-]S(=O)(=O)c1csnc1C(=O)[O-]	ZINC000582418381	564845648	/nfs/dbraw/zinc/84/56/48/564845648.db2.gz	VVZXTXSWKYLCFW-LBPRGKRZSA-N	-2	1	384.479	2.916	20	0		GFADML
O=C([O-])CCOc1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)cc1	ZINC000504681065	565042915	/nfs/dbraw/zinc/04/29/15/565042915.db2.gz	SAWDYZKBPLVAKJ-UHFFFAOYSA-N	-2	1	375.324	2.758	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-][C@@H](C)CCCCC(=O)[O-])c1F	ZINC000594570374	565399557	/nfs/dbraw/zinc/39/95/57/565399557.db2.gz	SAOPWBSCIOGHQG-VIFPVBQESA-N	-2	1	395.836	2.578	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C1CCC1	ZINC000663253694	565403813	/nfs/dbraw/zinc/40/38/13/565403813.db2.gz	BLDMWZRAYKQWNA-MRVPVSSYSA-N	-2	1	398.225	2.507	20	0		GFADML
O=C([O-])[C@@H]1CCCCCC[C@@H]1[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000646030543	565582264	/nfs/dbraw/zinc/58/22/64/565582264.db2.gz	NPLXMBSLENWYSN-PWSUYJOCSA-N	-2	1	380.388	2.802	20	0		GFADML
C[C@H]1CC[C@](C[N-]S(=O)(=O)c2ncccc2C(F)(F)F)(CC(=O)[O-])C1	ZINC000650412965	565817838	/nfs/dbraw/zinc/81/78/38/565817838.db2.gz	WDBRZSMNGBFZLA-IINYFYTJSA-N	-2	1	380.388	2.660	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](CC(=O)[O-])c2cccs2)c(F)c1	ZINC000681559230	566112430	/nfs/dbraw/zinc/11/24/30/566112430.db2.gz	YBNGFYCOEOIOPQ-NSHDSACASA-N	-2	1	377.390	2.529	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2CC(=O)[O-])cc1	ZINC000818181096	597314436	/nfs/dbraw/zinc/31/44/36/597314436.db2.gz	WZNPZEISHXXZHF-UHFFFAOYSA-N	-2	1	377.418	2.681	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1CC(=O)[O-]	ZINC000818772761	597452501	/nfs/dbraw/zinc/45/25/01/597452501.db2.gz	REAGYOJQZMUYGV-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc(OC)c1OC	ZINC000477423450	599905145	/nfs/dbraw/zinc/90/51/45/599905145.db2.gz	MTOYBNOOABQZFW-UHFFFAOYSA-N	-2	1	381.406	2.520	20	0		GFADML
CCN(Cc1ccccc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1C)C(C)=O	ZINC000477428217	599906419	/nfs/dbraw/zinc/90/64/19/599906419.db2.gz	QDKMYNKSLVHBJB-UHFFFAOYSA-N	-2	1	390.461	2.862	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(N(C)C(=O)[O-])cc2)c1C	ZINC000737713961	599907570	/nfs/dbraw/zinc/90/75/70/599907570.db2.gz	PGZKOQNRGFCWAN-UHFFFAOYSA-N	-2	1	378.406	2.697	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)c1C	ZINC000737713047	599908319	/nfs/dbraw/zinc/90/83/19/599908319.db2.gz	KQSJRSGRBWBDIQ-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc2c(c1)CCCC(=O)N2	ZINC000740303048	599926865	/nfs/dbraw/zinc/92/68/65/599926865.db2.gz	DBFHCEVAMWTRJO-UHFFFAOYSA-N	-2	1	378.381	2.600	20	0		GFADML
O=C([O-])c1ccc(C(F)(F)F)cc1S(=O)(=O)[N-]c1ccc2c(c1)OCO2	ZINC000740122360	600058292	/nfs/dbraw/zinc/05/82/92/600058292.db2.gz	AINLTWBHLYXZFR-UHFFFAOYSA-N	-2	1	389.307	2.933	20	0		GFADML
O=C([O-])CCSCc1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)c1	ZINC000739754114	600070216	/nfs/dbraw/zinc/07/02/16/600070216.db2.gz	ZZMGSJFIVPMZKW-UHFFFAOYSA-N	-3	1	395.458	2.894	20	0		GFADML
Cc1ccc(NC(=O)Cc2c(C)nc(-c3cccnc3)[n-]c2=O)c(C(=O)[O-])c1	ZINC000365351164	600072797	/nfs/dbraw/zinc/07/27/97/600072797.db2.gz	BDNMTSUSWLUWEV-UHFFFAOYSA-N	-2	1	378.388	2.740	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1cc(F)ccc1C(=O)[O-]	ZINC000738195593	600094181	/nfs/dbraw/zinc/09/41/81/600094181.db2.gz	LTPZSGMBESRWBO-UHFFFAOYSA-N	-2	1	385.394	2.745	20	0		GFADML
CC(=O)Nc1c(C)ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])c1C	ZINC000736155387	600097038	/nfs/dbraw/zinc/09/70/38/600097038.db2.gz	FVEIOUGLLPHJTG-UHFFFAOYSA-N	-2	1	380.397	2.900	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2cc(F)c(N3CCCC3)c(F)c2)cc1	ZINC000739886646	600244386	/nfs/dbraw/zinc/24/43/86/600244386.db2.gz	RKAMSWKCICQECD-UHFFFAOYSA-N	-2	1	396.415	2.993	20	0		GFADML
CC(=O)N(Cc1ccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])cc1)C(C)C	ZINC000736131676	600253846	/nfs/dbraw/zinc/25/38/46/600253846.db2.gz	VMAUIRWTWHSORP-UHFFFAOYSA-N	-2	1	390.461	2.943	20	0		GFADML
Cc1cc(NS(=O)(=O)c2cc(Cl)c(Cl)c(C(=O)[O-])c2)c(C(=O)[O-])[nH]1	ZINC000738463177	600255879	/nfs/dbraw/zinc/25/58/79/600255879.db2.gz	BEGHXYYLXUJILM-UHFFFAOYSA-N	-2	1	393.204	2.827	20	0		GFADML
O=C([O-])NCc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)cc1	ZINC000740000032	600302985	/nfs/dbraw/zinc/30/29/85/600302985.db2.gz	BAXQNWLFPHUMBW-UHFFFAOYSA-N	-2	1	389.433	2.530	20	0		GFADML
CC(C)N(CCC(=O)[O-])C(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000262446793	600596323	/nfs/dbraw/zinc/59/63/23/600596323.db2.gz	QNFVELNHGKVMPI-UHFFFAOYSA-N	-2	1	390.461	2.813	20	0		GFADML
CCOC(=O)c1cc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)ccc1Cl	ZINC000610500380	600628317	/nfs/dbraw/zinc/62/83/17/600628317.db2.gz	GJANLSVWGMGEDH-UHFFFAOYSA-N	-2	1	397.836	2.945	20	0		GFADML
O=C([O-])c1cc(Cl)cc([N-]S(=O)(=O)c2ccc(N3CCOC3=O)cc2)c1	ZINC000740072296	600694772	/nfs/dbraw/zinc/69/47/72/600694772.db2.gz	KSEDNDFMMFOMQE-UHFFFAOYSA-N	-2	1	396.808	2.796	20	0		GFADML
CC1CCN(c2ccc([N-]S(=O)(=O)c3cc(C(=O)[O-])n(C)c3)cc2)CC1	ZINC000828302055	600809403	/nfs/dbraw/zinc/80/94/03/600809403.db2.gz	CYYYQGAQFVNAEJ-UHFFFAOYSA-N	-2	1	377.466	2.760	20	0		GFADML
CNC(=O)c1cc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)ccc1Cl	ZINC000048382753	600811786	/nfs/dbraw/zinc/81/17/86/600811786.db2.gz	NUGSGIIAYRWSMT-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
C[C@H]1Oc2ccc([N-]S(=O)(=O)c3cc(Cl)cc(C(=O)[O-])c3)cc2NC1=O	ZINC000736832646	600888111	/nfs/dbraw/zinc/88/81/11/600888111.db2.gz	APJNXHJYVDKQCC-MRVPVSSYSA-N	-2	1	396.808	2.558	20	0		GFADML
CCCNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)c1	ZINC000506717658	600888841	/nfs/dbraw/zinc/88/88/41/600888841.db2.gz	DUNAZYWPEOJZBF-UHFFFAOYSA-N	-2	1	376.434	2.634	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)c1	ZINC000525330160	600899456	/nfs/dbraw/zinc/89/94/56/600899456.db2.gz	CGJAXRUXSPBOJN-UHFFFAOYSA-N	-2	1	391.445	2.945	20	0		GFADML
CC(C)c1ncc(S(=O)(=O)Oc2ccc(C(=O)[O-])cc2Br)[n-]1	ZINC000827153243	601212926	/nfs/dbraw/zinc/21/29/26/601212926.db2.gz	PKBSPLLRUXMEEA-UHFFFAOYSA-N	-2	1	389.227	2.762	20	0		GFADML
CC(C)c1nc(S(=O)(=O)Oc2ccc(C(=O)[O-])cc2Br)c[n-]1	ZINC000827153243	601212927	/nfs/dbraw/zinc/21/29/27/601212927.db2.gz	PKBSPLLRUXMEEA-UHFFFAOYSA-N	-2	1	389.227	2.762	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](c2ccccc2)[C@H](C)C(=O)[O-])c(F)c1	ZINC000681579794	601225285	/nfs/dbraw/zinc/22/52/85/601225285.db2.gz	VRUPFIOXWGERHZ-BONVTDFDSA-N	-2	1	385.388	2.714	20	0		GFADML
O=C([O-])c1cc(C(=O)Nc2cccc([N-]S(=O)(=O)c3ccccc3)c2)ccn1	ZINC000432114772	601248420	/nfs/dbraw/zinc/24/84/20/601248420.db2.gz	DSGLUAKKFQGZRT-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)CCC(=O)[O-])cc2)cc1C(=O)[O-]	ZINC000433512332	601250662	/nfs/dbraw/zinc/25/06/62/601250662.db2.gz	WARHTJRELGIOEF-UHFFFAOYSA-N	-3	1	391.401	2.542	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)ccc1F	ZINC000026236127	601319817	/nfs/dbraw/zinc/31/98/17/601319817.db2.gz	AIXZPCIZXNGIQM-UHFFFAOYSA-N	-2	1	381.381	2.728	20	0		GFADML
COC(=O)Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1	ZINC000029337981	601319851	/nfs/dbraw/zinc/31/98/51/601319851.db2.gz	JROUJLANSANSHA-UHFFFAOYSA-N	-2	1	377.418	2.518	20	0		GFADML
COCCOc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000614848300	601324413	/nfs/dbraw/zinc/32/44/13/601324413.db2.gz	IOLUVQMUNXDPNW-UHFFFAOYSA-N	-2	1	379.434	2.828	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1	ZINC000614832772	601324688	/nfs/dbraw/zinc/32/46/88/601324688.db2.gz	KCVDCSNQOFMZOG-UHFFFAOYSA-N	-2	1	376.434	2.552	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)c(F)c2)ccc1F	ZINC000732654531	601331380	/nfs/dbraw/zinc/33/13/80/601331380.db2.gz	YTVVYVIVBVWIFZ-UHFFFAOYSA-N	-2	1	396.371	2.591	20	0		GFADML
CCN(CC)c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cn1	ZINC000829687197	601359918	/nfs/dbraw/zinc/35/99/18/601359918.db2.gz	IDXIXDLJQXHDFR-GHXNOFRVSA-N	-2	1	375.450	2.826	20	0		GFADML
O=C([O-])c1cc(NS(=O)(=O)c2ccc(Cl)nc2C(=O)[O-])ccc1Cl	ZINC000833300864	601384495	/nfs/dbraw/zinc/38/44/95/601384495.db2.gz	PBSXKDUGOTWHJB-UHFFFAOYSA-N	-2	1	391.188	2.586	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1	ZINC000751143381	601484637	/nfs/dbraw/zinc/48/46/37/601484637.db2.gz	PPYWAAWVLHGNCD-UHFFFAOYSA-N	-3	1	399.371	2.826	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000754254767	601575714	/nfs/dbraw/zinc/57/57/14/601575714.db2.gz	DFSMYRXQRFZEHO-UHFFFAOYSA-N	-2	1	397.380	2.812	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(C(=O)NC3CC3)c2)ccc1Cl	ZINC000013302276	601826382	/nfs/dbraw/zinc/82/63/82/601826382.db2.gz	CPPUFYORVRCKIE-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1NC(C)=O	ZINC000024437090	601826788	/nfs/dbraw/zinc/82/67/88/601826788.db2.gz	UJTNOHMXVZWFOA-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
COc1c(F)cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1F	ZINC000751146372	601836527	/nfs/dbraw/zinc/83/65/27/601836527.db2.gz	RDOPHVALMVACFL-UHFFFAOYSA-N	-2	1	379.287	2.751	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3oc(=O)ccc3c2)cc(F)c1F	ZINC000751147154	601836607	/nfs/dbraw/zinc/83/66/07/601836607.db2.gz	ZHNDOQBSAWMMHX-UHFFFAOYSA-N	-2	1	381.312	2.570	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)Nc1cc(C(=O)[O-])ccc1OC(C)C	ZINC000477423789	601984607	/nfs/dbraw/zinc/98/46/07/601984607.db2.gz	QFPQASPJWLCZHA-UHFFFAOYSA-N	-2	1	393.417	2.979	20	0		GFADML
C[C@H](CC(=O)[O-])C(=O)Nc1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1	ZINC000827316589	602093005	/nfs/dbraw/zinc/09/30/05/602093005.db2.gz	BKJQMLCCKLRGCR-LLVKDONJSA-N	-2	1	380.397	2.676	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-][C@@H](Cc2ccccc2)C(F)(F)F)s1	ZINC000833325136	602214809	/nfs/dbraw/zinc/21/48/09/602214809.db2.gz	SUAZWWDVIFXDPK-NSHDSACASA-N	-2	1	379.381	2.898	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2cccc(OCCNC(=O)[O-])c2)cc1	ZINC000739502512	602455522	/nfs/dbraw/zinc/45/55/22/602455522.db2.gz	BXEXUTOWFXGMPU-UHFFFAOYSA-N	-2	1	380.422	2.533	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCN3C(=O)[O-])cc1	ZINC000738573960	602646023	/nfs/dbraw/zinc/64/60/23/602646023.db2.gz	WWWLWSFLHJKNAG-UHFFFAOYSA-N	-2	1	389.433	2.876	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)CCCN3C(=O)[O-])cs1	ZINC000740716406	602646748	/nfs/dbraw/zinc/64/67/48/602646748.db2.gz	LZXHXPBMPJCOQI-UHFFFAOYSA-N	-3	1	382.419	2.678	20	0		GFADML
CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000739305117	602856854	/nfs/dbraw/zinc/85/68/54/602856854.db2.gz	LNHQNHGXXDUUCC-OLZOCXBDSA-N	-2	1	377.441	2.639	20	0		GFADML
O=C([O-])N1CCCC[C@@H](NC(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)C1	ZINC000740729158	602972413	/nfs/dbraw/zinc/97/24/13/602972413.db2.gz	LUYYNSHNCOTWBW-MRXNPFEDSA-N	-2	1	389.452	2.529	20	0		GFADML
CC(C)(C)OC(=O)NC[C@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])C1CC1	ZINC000738718673	603103696	/nfs/dbraw/zinc/10/36/96/603103696.db2.gz	ZOOMXNYAYXKCJT-ZDUSSCGKSA-N	-2	1	379.413	2.515	20	0		GFADML
CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H]1NC(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000823816906	603910348	/nfs/dbraw/zinc/91/03/48/603910348.db2.gz	GSHLRQIRLLIPAR-SMDDNHRTSA-N	-2	1	393.440	2.905	20	0		GFADML
COCCc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])cc1	ZINC000829023775	604014413	/nfs/dbraw/zinc/01/44/13/604014413.db2.gz	GMGWBKPHMMKSCT-UHFFFAOYSA-N	-2	1	376.434	2.717	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCN3C(=O)[O-])cc1	ZINC000831815840	604045554	/nfs/dbraw/zinc/04/55/54/604045554.db2.gz	SWBUKXQQQKIYRL-UHFFFAOYSA-N	-3	1	390.417	2.545	20	0		GFADML
C[C@@H](CN(C)C(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000824873327	604074709	/nfs/dbraw/zinc/07/47/09/604074709.db2.gz	FHIAGXNCZIDBPF-ZDUSSCGKSA-N	-2	1	391.449	2.672	20	0		GFADML
O=C([O-])c1cncc(NC(=O)c2ccc([N-]S(=O)(=O)c3ccccc3)cc2)c1	ZINC000833341140	604909589	/nfs/dbraw/zinc/90/95/89/604909589.db2.gz	JJYWBVLPZKYWGY-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
CC(=O)N(C)c1cccc([N-]S(=O)(=O)c2cccc3c2ccnc3C(=O)[O-])c1	ZINC000833389134	605151040	/nfs/dbraw/zinc/15/10/40/605151040.db2.gz	GIGLMGCJELELHG-UHFFFAOYSA-N	-2	1	399.428	2.717	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCOC[C@@H]2C[C@H](O)c2cccs2)c([O-])c1	ZINC000834258553	605655658	/nfs/dbraw/zinc/65/56/58/605655658.db2.gz	QMZWRSWZISUEAD-WFASDCNBSA-N	-2	1	392.433	2.508	20	0		GFADML
O=C([O-])N[C@H](CNC(=O)c1ccc(Br)c([O-])c1)c1ccccc1	ZINC000834146389	605936879	/nfs/dbraw/zinc/93/68/79/605936879.db2.gz	IBFNQDWVRJBDSH-CYBMUJFWSA-N	-2	1	379.210	2.893	20	0		GFADML
CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ncc(-c3nn[n-]n3)s2)cc1	ZINC000820848402	660308065	/nfs/dbraw/zinc/30/80/65/660308065.db2.gz	XDBZEALTPXRBQT-UHFFFAOYSA-N	-2	1	378.483	2.812	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2ccc(F)c(Cl)c2)cc(C(=O)[O-])c1OC	ZINC000045946899	654672661	/nfs/dbraw/zinc/67/26/61/654672661.db2.gz	DKKXEHZPIGJWMF-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2ccccc2SC)cc(C(=O)[O-])c1OC	ZINC000045947054	654672713	/nfs/dbraw/zinc/67/27/13/654672713.db2.gz	BARMCGQMOICSSY-UHFFFAOYSA-N	-2	1	383.447	2.925	20	0		GFADML
CSc1ccccc1[N-]S(=O)(=O)c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000057115912	654800668	/nfs/dbraw/zinc/80/06/68/654800668.db2.gz	SDTRBVSGFOQVCR-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)c1ccc(Br)cc1[O-]	ZINC000066043277	654893035	/nfs/dbraw/zinc/89/30/35/654893035.db2.gz	CYDXFCVWSXEXIQ-UHFFFAOYSA-N	-2	1	394.250	2.725	20	0		GFADML
C[C@@H](CC[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)C(=O)[O-]	ZINC000776590469	656764266	/nfs/dbraw/zinc/76/42/66/656764266.db2.gz	TXSGTZVCAQNVHZ-LURJTMIESA-N	-2	1	388.642	2.631	20	0		GFADML
Cc1c[nH]nc1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000788199928	657669389	/nfs/dbraw/zinc/66/93/89/657669389.db2.gz	SEDMJMDWZXNGRA-UHFFFAOYSA-N	-2	1	378.435	2.538	20	0		GFADML
O=C([O-])c1cc(Cl)c(Cl)c(S(=O)(=O)[N-]CCOC(F)(F)F)c1	ZINC000788738013	657780632	/nfs/dbraw/zinc/78/06/32/657780632.db2.gz	TUNBKBBMCRNZGQ-UHFFFAOYSA-N	-2	1	382.143	2.506	20	0		GFADML
Cc1cc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2O)cc(C(=O)[O-])c1Cl	ZINC000788752617	657782991	/nfs/dbraw/zinc/78/29/91/657782991.db2.gz	DLXWDLDNYYISLH-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
COc1cc(Cl)c(S(=O)(=O)[N-]c2cc(C(C)(C)C)n[nH]2)cc1C(=O)[O-]	ZINC000790393348	657967052	/nfs/dbraw/zinc/96/70/52/657967052.db2.gz	HCBXHNCWMVSJJP-UHFFFAOYSA-N	-2	1	387.845	2.868	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC[C@@H]1C(F)F	ZINC000868602442	662611505	/nfs/dbraw/zinc/61/15/05/662611505.db2.gz	WSADRVZOYULSHL-LLVKDONJSA-N	-2	1	388.417	2.734	20	0		GFADML
O=S(=O)([N-]c1cnn(CC(F)F)c1)c1c([O-])cccc1OC(F)(F)F	ZINC000901891143	663749455	/nfs/dbraw/zinc/74/94/55/663749455.db2.gz	CCSHKIYSDMIJQW-UHFFFAOYSA-N	-2	1	387.286	2.553	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)ccc1F	ZINC000392966085	677410340	/nfs/dbraw/zinc/41/03/40/677410340.db2.gz	MRGQODJKOABEKN-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1ccc(Br)cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(O)c1	ZINC000013464536	551108798	/nfs/dbraw/zinc/10/87/98/551108798.db2.gz	JPBBKIVXDAWALX-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
Cc1csc([C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)C2CC2)n1	ZINC000185063534	552353114	/nfs/dbraw/zinc/35/31/14/552353114.db2.gz	CMIUUQHBOBWWOP-ZDUSSCGKSA-N	-2	1	388.417	2.858	20	0		GFADML
NC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)ccc1Cl	ZINC000327061962	563456458	/nfs/dbraw/zinc/45/64/58/563456458.db2.gz	ALFZEDBJCGEXIK-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(N2CCCC2=O)cc1	ZINC000327465777	563458668	/nfs/dbraw/zinc/45/86/68/563458668.db2.gz	XUBXHCOMFVSBTN-UHFFFAOYSA-N	-2	1	380.447	2.682	20	0		GFADML
O=C([O-])C[C@@H](CC[N-]S(=O)(=O)c1cc(F)ccc1Cl)C(F)(F)F	ZINC000284981829	563498140	/nfs/dbraw/zinc/49/81/40/563498140.db2.gz	FXEIRHPEUZOAST-SSDOTTSWSA-N	-2	1	377.743	2.801	20	0		GFADML
Cc1cc(C)c([N-]S(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)c(C(=O)[O-])c1	ZINC000410394108	563589272	/nfs/dbraw/zinc/58/92/72/563589272.db2.gz	UPMBFWDJIHULHW-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C(N[C@H]1CCC[C@H]1F)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436774918	563679575	/nfs/dbraw/zinc/67/95/75/563679575.db2.gz	YFUMBVVKOCWAFW-OLZOCXBDSA-N	-2	1	384.454	2.875	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C)cc2-c2nnc[nH]2)sc1C(=O)[O-]	ZINC000361071936	563696664	/nfs/dbraw/zinc/69/66/64/563696664.db2.gz	ZPNLEEACYBSPIG-UHFFFAOYSA-N	-2	1	378.435	2.649	20	0		GFADML
CSc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)c1C	ZINC000540290193	564244012	/nfs/dbraw/zinc/24/40/12/564244012.db2.gz	BVELKARZWGXXLS-UHFFFAOYSA-N	-3	1	381.431	2.914	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2ccc3ncsc3c2)cc1F	ZINC000509575285	564304277	/nfs/dbraw/zinc/30/42/77/564304277.db2.gz	VGBKLNSNWPBBBG-UHFFFAOYSA-N	-2	1	382.394	2.700	20	0		GFADML
Cc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(Cl)c1C	ZINC000476434458	564339807	/nfs/dbraw/zinc/33/98/07/564339807.db2.gz	XKRSBIFVPORAHV-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccccc2C[S@](C)=O)c(C)c1C(=O)[O-]	ZINC000545122721	564409157	/nfs/dbraw/zinc/40/91/57/564409157.db2.gz	BSILVGYEKHWLOB-DEOSSOPVSA-N	-2	1	381.475	2.681	20	0		GFADML
COC(=O)c1cc(Cl)ccc1S(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1F	ZINC000512771870	564410924	/nfs/dbraw/zinc/41/09/24/564410924.db2.gz	QMOMMTYQHMGCAS-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CC(C)n1cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2Br)cn1	ZINC000568739533	564432539	/nfs/dbraw/zinc/43/25/39/564432539.db2.gz	NFQPFAWAXNIYFO-UHFFFAOYSA-N	-2	1	388.243	2.726	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)cc1C(=O)[O-]	ZINC000479254089	564433844	/nfs/dbraw/zinc/43/38/44/564433844.db2.gz	SCSMGURENKVSKB-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1cccc(CC(=O)[O-])c1	ZINC000479472698	564441404	/nfs/dbraw/zinc/44/14/04/564441404.db2.gz	XJWACSCUJUYPDB-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cc2c(cc1C(=O)[O-])OCCO2	ZINC000515692292	564486058	/nfs/dbraw/zinc/48/60/58/564486058.db2.gz	SAIPVCCFEKHMFB-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
C[C@@H]([C@@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-])C1CC1	ZINC000515872323	564489585	/nfs/dbraw/zinc/48/95/85/564489585.db2.gz	YSEDXTBYSZYBLC-SREIQFSDSA-N	-2	1	398.225	2.505	20	0		GFADML
CCCSC[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000548250464	564543903	/nfs/dbraw/zinc/54/39/03/564543903.db2.gz	YVVRIKZZQLJICD-ZCFIWIBFSA-N	-2	1	378.324	2.930	20	0		GFADML
CSCc1cccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(F)c2)c1	ZINC000521003402	564617696	/nfs/dbraw/zinc/61/76/96/564617696.db2.gz	GNYGNXQSUIOUHQ-UHFFFAOYSA-N	-2	1	385.438	2.953	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2c(C)cccc2C(=O)[O-])c1	ZINC000525006996	564692159	/nfs/dbraw/zinc/69/21/59/564692159.db2.gz	VTCNQKLSTNUSAS-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(O)c2F)c1OC	ZINC000575336386	564696273	/nfs/dbraw/zinc/69/62/73/564696273.db2.gz	GCOUZVPFYRKIQF-UHFFFAOYSA-N	-2	1	389.788	2.781	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(C)(C)C(=O)[O-])cc1	ZINC000525329633	564698258	/nfs/dbraw/zinc/69/82/58/564698258.db2.gz	CJHCZUINWVSQTO-UHFFFAOYSA-N	-3	1	383.447	2.918	20	0		GFADML
C[C@@H](C(=O)[O-])[C@H](C)[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000556702385	564836695	/nfs/dbraw/zinc/83/66/95/564836695.db2.gz	CLHSMPQZPDVVMY-UHNVWZDZSA-N	-2	1	376.681	2.552	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])ccc1C	ZINC000467078243	564955087	/nfs/dbraw/zinc/95/50/87/564955087.db2.gz	GJGMFEFARSUZDJ-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc2c(c1)N(C)CC2	ZINC000468780351	564993453	/nfs/dbraw/zinc/99/34/53/564993453.db2.gz	BHXRPRKFAFGXDQ-UHFFFAOYSA-N	-2	1	378.475	2.900	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2ccc(S[C@H](C)C(=O)[O-])cc2)cn1	ZINC000504702106	565042735	/nfs/dbraw/zinc/04/27/35/565042735.db2.gz	DAGKXFFCNUYHAA-LLVKDONJSA-N	-2	1	382.463	2.846	20	0		GFADML
CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000657144187	565077703	/nfs/dbraw/zinc/07/77/03/565077703.db2.gz	DEEIIRNFBDUZPZ-KOLCDFICSA-N	-2	1	380.388	2.658	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2cc3c(cc2C(=O)[O-])OCCO3)cc1Cl	ZINC000614764959	565131705	/nfs/dbraw/zinc/13/17/05/565131705.db2.gz	VVAXDHMMYQXTHE-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)c(C)c1	ZINC000591681538	565236529	/nfs/dbraw/zinc/23/65/29/565236529.db2.gz	QFEYGCWTBHMQGA-UHFFFAOYSA-N	-2	1	385.463	2.889	20	0		GFADML
Cc1nc(S(=O)(=O)[N-][C@H](CC(F)(F)F)C(=O)[O-])c(-c2ccccc2)s1	ZINC000663286298	565406166	/nfs/dbraw/zinc/40/61/66/565406166.db2.gz	QFLNMKHYHVWPQZ-SNVBAGLBSA-N	-2	1	394.396	2.802	20	0		GFADML
CC1(C)C[C@@H]([N-]S(=O)(=O)c2csnc2C(=O)[O-])c2cc(F)ccc2O1	ZINC000650443489	565822556	/nfs/dbraw/zinc/82/25/56/565822556.db2.gz	CQAWORJPLSCHNG-SNVBAGLBSA-N	-2	1	386.426	2.561	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCC4(CCCCC4)CC3)cc2)[n-]1	ZINC000739874288	599838063	/nfs/dbraw/zinc/83/80/63/599838063.db2.gz	QJUXFDSGLQZLDL-UHFFFAOYSA-N	-2	1	397.475	2.979	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)c1	ZINC000477428769	600396044	/nfs/dbraw/zinc/39/60/44/600396044.db2.gz	PSJGTKJDXQFRTO-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc(-c3cn4cccnc4n3)c2)cc1	ZINC000605497150	600423329	/nfs/dbraw/zinc/42/33/29/600423329.db2.gz	FYJURJCUGMBDED-UHFFFAOYSA-N	-2	1	394.412	2.895	20	0		GFADML
O=C([O-])c1ccc(C(F)(F)F)cc1S(=O)(=O)[N-]c1ccc2nccn2c1	ZINC000740124238	600513167	/nfs/dbraw/zinc/51/31/67/600513167.db2.gz	SECRUFZHKSIASB-UHFFFAOYSA-N	-2	1	385.323	2.852	20	0		GFADML
CC(C)(C)[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1)C(=O)[O-]	ZINC000675984155	600530815	/nfs/dbraw/zinc/53/08/15/600530815.db2.gz	APIVRRCOUYPWOC-INIZCTEOSA-N	-2	1	390.461	2.717	20	0		GFADML
C[C@H]1CCC[C@@H](CCNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736775200	600622344	/nfs/dbraw/zinc/62/23/44/600622344.db2.gz	NBJQDMGKHROLLS-GJZGRUSLSA-N	-2	1	385.464	2.739	20	0		GFADML
Cc1cc(C)n(-c2cccc([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)c2)n1	ZINC000175000241	600626289	/nfs/dbraw/zinc/62/62/89/600626289.db2.gz	PSPDCUQLRQXIDQ-UHFFFAOYSA-N	-2	1	385.445	2.917	20	0		GFADML
CC(C)(C)NC(=O)c1cccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)c1	ZINC000267185180	600626393	/nfs/dbraw/zinc/62/63/93/600626393.db2.gz	NMTVHKXLDLNVFO-UHFFFAOYSA-N	-2	1	390.461	2.643	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)cc1	ZINC000736232822	600678304	/nfs/dbraw/zinc/67/83/04/600678304.db2.gz	OZRWBKJLZZYDRR-UHFFFAOYSA-N	-2	1	399.371	2.826	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(Oc3ccc(Cl)nn3)cc2)c[nH]1	ZINC000733251328	600682705	/nfs/dbraw/zinc/68/27/05/600682705.db2.gz	MOOCWOAZAXFCRC-UHFFFAOYSA-N	-2	1	394.796	2.749	20	0		GFADML
CCOc1ccc(F)c(C(=O)[O-])c1NS(=O)(=O)c1ccc(C(=O)[O-])cc1C	ZINC000466269759	600683644	/nfs/dbraw/zinc/68/36/44/600683644.db2.gz	LDAYUNQGIYATCA-UHFFFAOYSA-N	-2	1	397.380	2.730	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1sccc1Br)c1ccccc1	ZINC000061609459	600775434	/nfs/dbraw/zinc/77/54/34/600775434.db2.gz	UKIMPQQHDVBUOR-JTQLQIEISA-N	-2	1	390.280	2.657	20	0		GFADML
CCCNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000042792130	600809892	/nfs/dbraw/zinc/80/98/92/600809892.db2.gz	AFKYGGNHXAASGP-UHFFFAOYSA-N	-2	1	376.434	2.634	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3nccn3c2)c(Br)c1	ZINC000738689475	600983672	/nfs/dbraw/zinc/98/36/72/600983672.db2.gz	PISVHWLSRAMNQN-UHFFFAOYSA-N	-2	1	396.222	2.596	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccc([S@](=O)C(F)(F)F)cc2)c1	ZINC000748676227	601126868	/nfs/dbraw/zinc/12/68/68/601126868.db2.gz	YHUBUESRXZJERU-DEOSSOPVSA-N	-2	1	393.364	2.813	20	0		GFADML
CC(C)c1ncc(S(=O)(=O)Oc2ccc(Br)cc2C(=O)[O-])[n-]1	ZINC000827152709	601230974	/nfs/dbraw/zinc/23/09/74/601230974.db2.gz	JRKQEDXMGPWJHS-UHFFFAOYSA-N	-2	1	389.227	2.762	20	0		GFADML
CC(C)c1nc(S(=O)(=O)Oc2ccc(Br)cc2C(=O)[O-])c[n-]1	ZINC000827152709	601230975	/nfs/dbraw/zinc/23/09/75/601230975.db2.gz	JRKQEDXMGPWJHS-UHFFFAOYSA-N	-2	1	389.227	2.762	20	0		GFADML
O=C([O-])CC1([N-]S(=O)(=O)c2sccc2Br)CCCCC1	ZINC000084147419	601265815	/nfs/dbraw/zinc/26/58/15/601265815.db2.gz	NPHPJXFDAMILBD-UHFFFAOYSA-N	-2	1	382.301	2.967	20	0		GFADML
O=C([O-])c1cc(C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccccc3)cc2)ccn1	ZINC000833157176	601272502	/nfs/dbraw/zinc/27/25/02/601272502.db2.gz	MWYOULYDXBGFTO-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc(OC)c1OC	ZINC000013345497	601317305	/nfs/dbraw/zinc/31/73/05/601317305.db2.gz	VYAAQDWCYSIXDX-RMKNXTFCSA-N	-2	1	393.417	2.611	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)ccc1F	ZINC000025510095	601319990	/nfs/dbraw/zinc/31/99/90/601319990.db2.gz	HLCOGRUBRLBOGO-UHFFFAOYSA-N	-2	1	380.397	2.900	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1C	ZINC000831434818	601330399	/nfs/dbraw/zinc/33/03/99/601330399.db2.gz	FMIGVZROACGCKA-BJMVGYQFSA-N	-2	1	375.402	2.680	20	0		GFADML
Cc1nnc(-c2ccc([N-]S(=O)(=O)c3ccc(/C=C/C(=O)[O-])cc3)cc2)o1	ZINC000833017639	601333577	/nfs/dbraw/zinc/33/35/77/601333577.db2.gz	QZTBWKHHQBSOKK-NYYWCZLTSA-N	-2	1	385.401	2.944	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C)c(C(=O)[O-])c2)ccc1F	ZINC000743266097	601334382	/nfs/dbraw/zinc/33/43/82/601334382.db2.gz	FJOCXMNNMYJJCX-UHFFFAOYSA-N	-2	1	381.381	2.810	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2ccc(Cl)cc2)c(F)c1	ZINC000832011169	601388129	/nfs/dbraw/zinc/38/81/29/601388129.db2.gz	RQIBZWYOTOEUGH-CYBMUJFWSA-N	-2	1	391.779	2.731	20	0		GFADML
Cc1cc(C)c(C(=O)[O-])c([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1	ZINC000751141932	601485798	/nfs/dbraw/zinc/48/57/98/601485798.db2.gz	IXDOWZSGPWPSPI-UHFFFAOYSA-N	-3	1	385.344	2.779	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)ccc1C	ZINC000751141240	601485958	/nfs/dbraw/zinc/48/59/58/601485958.db2.gz	DTZWSIYEMLTAMZ-UHFFFAOYSA-N	-2	1	385.344	2.559	20	0		GFADML
Cc1cc([C@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)ccc1F	ZINC000832871139	601748061	/nfs/dbraw/zinc/74/80/61/601748061.db2.gz	OQCGRKPVMWYTGT-ZDUSSCGKSA-N	-2	1	397.406	2.731	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000737939283	601828833	/nfs/dbraw/zinc/82/88/33/601828833.db2.gz	AFHUWGNDRHCUCX-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
Cc1ccc(N2CCOC2=O)cc1[N-]S(=O)(=O)c1cccc(F)c1C(=O)[O-]	ZINC000832938042	601862844	/nfs/dbraw/zinc/86/28/44/601862844.db2.gz	FJSLXOYAXMDOEH-UHFFFAOYSA-N	-2	1	394.380	2.590	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1sccc1Br)[C@H]1CCCN(C(=O)[O-])C1	ZINC000739036346	601991503	/nfs/dbraw/zinc/99/15/03/601991503.db2.gz	DJFXVORAJLHMQY-IUCAKERBSA-N	-2	1	397.316	2.567	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)N[C@H]1CCCCCC[C@@H]1C(=O)[O-]	ZINC000262992344	602052384	/nfs/dbraw/zinc/05/23/84/602052384.db2.gz	SRZYRYJEXUYHJT-RDJZCZTQSA-N	-2	1	398.463	2.635	20	0		GFADML
Cc1ccc(NC(=O)[C@H](C)CC(=O)[O-])cc1[N-]S(=O)(=O)c1ccccc1	ZINC000832943003	602098138	/nfs/dbraw/zinc/09/81/38/602098138.db2.gz	LFBDPVFMMLMPFB-CYBMUJFWSA-N	-2	1	376.434	2.845	20	0		GFADML
O=C([O-])c1cc(Br)ccc1S(=O)(=O)[N-]c1cc(C2CC2)n[nH]1	ZINC000833296096	602306698	/nfs/dbraw/zinc/30/66/98/602306698.db2.gz	QKOCAELQCBBXRJ-UHFFFAOYSA-N	-2	1	386.227	2.549	20	0		GFADML
COC(=O)c1c(C)oc(C)c1S(=O)(=O)[N-]c1cc(NC(=O)[O-])ccc1F	ZINC000739777765	602654810	/nfs/dbraw/zinc/65/48/10/602654810.db2.gz	GRPSNTWCWUONPX-UHFFFAOYSA-N	-2	1	386.357	2.713	20	0		GFADML
O=C([O-])NCc1nc(C(=O)[N-]c2nnc(Cc3ccc(F)cc3)s2)cs1	ZINC000740685435	602704079	/nfs/dbraw/zinc/70/40/79/602704079.db2.gz	JZVIPEVQIMVEON-UHFFFAOYSA-N	-2	1	393.425	2.744	20	0		GFADML
CCOc1ccccc1N1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000739509520	602840380	/nfs/dbraw/zinc/84/03/80/602840380.db2.gz	IVDGZGDIWLZKOJ-UHFFFAOYSA-N	-2	1	385.420	2.843	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCC(CNC(=O)[O-])CC2)c([O-])c1	ZINC000738722243	602855716	/nfs/dbraw/zinc/85/57/16/602855716.db2.gz	BRDPOJIHUDXGOC-UHFFFAOYSA-N	-2	1	393.440	2.859	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(C(=O)NC3CCCCC3)CC2)c([O-])c1	ZINC000740700491	602855924	/nfs/dbraw/zinc/85/59/24/602855924.db2.gz	YPFQLYSTEOXAJF-UHFFFAOYSA-N	-2	1	389.452	2.783	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)NC[C@@H]2CCCN2C(=O)[O-])c([O-])c1	ZINC000738723016	602862357	/nfs/dbraw/zinc/86/23/57/602862357.db2.gz	KFQBMXFDCAVCSJ-LBPRGKRZSA-N	-2	1	379.413	2.611	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCC(=O)OCc2ccccc2Cl)c([O-])c1	ZINC000740699066	602866400	/nfs/dbraw/zinc/86/64/00/602866400.db2.gz	OXYWFRPKLHJMID-UHFFFAOYSA-N	-2	1	378.768	2.609	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000739167583	602870114	/nfs/dbraw/zinc/87/01/14/602870114.db2.gz	MQKDLGSUGOVBNZ-RISCZKNCSA-N	-2	1	393.440	2.857	20	0		GFADML
O=C([O-])N1CCc2c(cccc2[N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)C1	ZINC000740530208	603230563	/nfs/dbraw/zinc/23/05/63/603230563.db2.gz	VXWWRAWXHQFCPK-UHFFFAOYSA-N	-2	1	386.351	2.941	20	0		GFADML
C[C@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)oc3c2)cc1	ZINC000825448311	603402121	/nfs/dbraw/zinc/40/21/21/603402121.db2.gz	CLGQFAHWMVSHDG-VIFPVBQESA-N	-2	1	377.378	2.663	20	0		GFADML
CCOc1cc(-c2noc(C[C@H](C)NC(=O)[O-])n2)cc(Br)c1[O-]	ZINC000827410106	603409070	/nfs/dbraw/zinc/40/90/70/603409070.db2.gz	WPHAYGWKDJTBIT-ZETCQYMHSA-N	-2	1	386.202	2.802	20	0		GFADML
CCc1cc2c(COC(=O)[C@H]3CC[C@@H](NC(=O)[O-])C3)cc(=O)oc2cc1[O-]	ZINC000827571124	604056065	/nfs/dbraw/zinc/05/60/65/604056065.db2.gz	XHWMELRNWZLJSE-WCQYABFASA-N	-2	1	375.377	2.541	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)c(C(=O)[O-])c1	ZINC000767732344	604631642	/nfs/dbraw/zinc/63/16/42/604631642.db2.gz	CKKGTCPLNBODDE-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)[N-]c2ccc(C)c(C(=O)[O-])c2)c1C	ZINC000484802357	604769519	/nfs/dbraw/zinc/76/95/19/604769519.db2.gz	AOKVGPOEYQRNMZ-UHFFFAOYSA-N	-2	1	380.422	2.616	20	0		GFADML
CC[C@](C)([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000828693665	604811419	/nfs/dbraw/zinc/81/14/19/604811419.db2.gz	YYKAMUIBELBQFA-VIFPVBQESA-N	-2	1	376.681	2.696	20	0		GFADML
CN(C(=O)c1ccc(NC(=O)[O-])cc1[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000827937925	604920675	/nfs/dbraw/zinc/92/06/75/604920675.db2.gz	DBZSCJCORNBVEO-GFCCVEGCSA-N	-2	1	379.413	2.564	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(C3(C(=O)[O-])CC3)cc2)ccc1C	ZINC000833398868	605123898	/nfs/dbraw/zinc/12/38/98/605123898.db2.gz	VDMUJTCWQJUHLW-UHFFFAOYSA-N	-2	1	388.445	2.870	20	0		GFADML
CC(C)CNC(=O)c1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000485273053	605160560	/nfs/dbraw/zinc/16/05/60/605160560.db2.gz	OVERXZSTMFOYAW-UHFFFAOYSA-N	-2	1	394.424	2.711	20	0		GFADML
CC(C)Oc1c(F)cc([N-]S(=O)(=O)c2ccc(O)c(C(=O)[O-])c2)cc1F	ZINC000833505551	605330647	/nfs/dbraw/zinc/33/06/47/605330647.db2.gz	NYXZBYGSQBTVFC-UHFFFAOYSA-N	-2	1	387.360	2.957	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2)c([O-])c1	ZINC000834254251	605631155	/nfs/dbraw/zinc/63/11/55/605631155.db2.gz	BKWSVZPXDMBPCF-CQSZACIVSA-N	-2	1	387.417	2.636	20	0		GFADML
C[C@@H]1CN(C(=O)[O-])[C@@H](C)CN1C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-]	ZINC000833835700	605837466	/nfs/dbraw/zinc/83/74/66/605837466.db2.gz	CSFJCDPPNAHFFE-NEPJUHHUSA-N	-2	1	393.440	2.952	20	0		GFADML
Cc1ccc(Cl)c(S(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)c1	ZINC000826289384	608227851	/nfs/dbraw/zinc/22/78/51/608227851.db2.gz	XXNZSNHPZKZWMV-UHFFFAOYSA-N	-2	1	395.876	2.581	20	0		GFADML
Cc1sc2ccc(Cl)cc2c1S(=O)(=O)[N-]c1n[nH]cc1-c1nn[n-]n1	ZINC000826350330	608307217	/nfs/dbraw/zinc/30/72/17/608307217.db2.gz	RBRCNCGAIHMNJX-UHFFFAOYSA-N	-2	1	395.857	2.567	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(-n2cncn2)c(Cl)c1	ZINC000729665770	655566545	/nfs/dbraw/zinc/56/65/45/655566545.db2.gz	MDWBZFXFOXLJDM-UHFFFAOYSA-N	-2	1	398.853	2.790	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])sc1Br)C(F)F	ZINC000840889678	661199040	/nfs/dbraw/zinc/19/90/40/661199040.db2.gz	GNXPFLAPCQFDQA-SCSAIBSYSA-N	-2	1	378.216	2.531	20	0		GFADML
C[C@H]1CC[C@](C[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)(CC(=O)[O-])C1	ZINC000776626195	656770367	/nfs/dbraw/zinc/77/03/67/656770367.db2.gz	LLSWVBKKENEJHW-LKFCYVNXSA-N	-2	1	381.281	2.948	20	0		GFADML
COc1cc(Cl)c(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2)cc1C(=O)[O-]	ZINC000790382263	657965369	/nfs/dbraw/zinc/96/53/69/657965369.db2.gz	RBEKKPUMXDRKGC-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
CCC[C@@H](C(=O)OCC)S(=O)(=O)[N-]c1cc(C)cc(Br)c1[O-]	ZINC000844660158	661432837	/nfs/dbraw/zinc/43/28/37/661432837.db2.gz	OBJBXYADXPMKDT-LBPRGKRZSA-N	-2	1	394.287	2.937	20	0		GFADML
O=C([O-])CC[C@H](C[N-]S(=O)(=O)c1cnc(Cl)c(Cl)c1)C(F)(F)F	ZINC000853071484	661880970	/nfs/dbraw/zinc/88/09/70/661880970.db2.gz	LLRHGKDHQWXMNF-ZCFIWIBFSA-N	-2	1	395.186	2.710	20	0		GFADML
O=C([O-])C[C@H]1COCC[C@H]1[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000899948488	663703436	/nfs/dbraw/zinc/70/34/36/663703436.db2.gz	FPJRZWTXKPFNGQ-GXSJLCMTSA-N	-2	1	389.882	2.713	20	0		GFADML
COc1cc(C(=O)NC[C@H](SCC(=O)[O-])C(F)(F)F)cc(Cl)c1[O-]	ZINC000910350370	664206834	/nfs/dbraw/zinc/20/68/34/664206834.db2.gz	SRKMQAVBXGAANB-VIFPVBQESA-N	-2	1	387.763	2.533	20	0		GFADML
O=C(NCc1ccc[nH]1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000174966850	552112962	/nfs/dbraw/zinc/11/29/62/552112962.db2.gz	VFZAQUJHVLQVHD-UHFFFAOYSA-N	-2	1	377.447	2.513	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F)c1nc(C)cs1	ZINC000185007339	552350863	/nfs/dbraw/zinc/35/08/63/552350863.db2.gz	FDTALOYKWDEUOF-JTQLQIEISA-N	-2	1	376.406	2.858	20	0		GFADML
Cc1ncc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Br)s1	ZINC000230092538	553064226	/nfs/dbraw/zinc/06/42/26/553064226.db2.gz	YSAJETYPRGAAPD-UHFFFAOYSA-N	-2	1	377.241	2.713	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)C(=O)[O-]	ZINC000262469026	553171408	/nfs/dbraw/zinc/17/14/08/553171408.db2.gz	UCAHOFDQDSVVBN-SECBINFHSA-N	-2	1	388.642	2.629	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cl)c(C(=O)[O-])c1	ZINC000326988693	563456677	/nfs/dbraw/zinc/45/66/77/563456677.db2.gz	MJKJTQDQANJXJV-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
C[C@H]1CSC[C@@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436623230	563675320	/nfs/dbraw/zinc/67/53/20/563675320.db2.gz	GCCXGGXFIXZOPV-GWCFXTLKSA-N	-2	1	398.531	2.736	20	0		GFADML
O=C(N[C@H]1CC[C@H](F)C1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436744171	563678708	/nfs/dbraw/zinc/67/87/08/563678708.db2.gz	KBOLLTXNGLFZIN-QWRGUYRKSA-N	-2	1	384.454	2.875	20	0		GFADML
O=S(=O)([N-]c1cccc([N-]S(=O)(=O)c2ccccc2)c1)c1ccco1	ZINC000437683460	563698187	/nfs/dbraw/zinc/69/81/87/563698187.db2.gz	BXNOOEKXFQHROT-UHFFFAOYSA-N	-2	1	378.431	2.881	20	0		GFADML
Cn1cc(S(=O)(=O)Nc2cc(Cl)c(Cl)c(C(=O)[O-])c2)cc1C(=O)[O-]	ZINC000443375351	563803114	/nfs/dbraw/zinc/80/31/14/563803114.db2.gz	NRHJCKNYOUHQOS-UHFFFAOYSA-N	-2	1	393.204	2.529	20	0		GFADML
Cc1oc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cc(F)c(OC(F)F)cc1F	ZINC000447274861	563879173	/nfs/dbraw/zinc/87/91/73/563879173.db2.gz	PBYRMRUSXOXXLC-UHFFFAOYSA-N	-2	1	383.275	2.967	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)c(C(=O)[O-])c1	ZINC000507603709	564234676	/nfs/dbraw/zinc/23/46/76/564234676.db2.gz	KATZFSMBEWAFDT-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1F	ZINC000474304804	564274538	/nfs/dbraw/zinc/27/45/38/564274538.db2.gz	FRTVSQOTQNAJBT-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(CC(=O)[O-])c1	ZINC000476409089	564338242	/nfs/dbraw/zinc/33/82/42/564338242.db2.gz	BIPWLKWQZMVYRI-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
Cc1c(C[S@@](C)=O)cccc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000477413712	564375913	/nfs/dbraw/zinc/37/59/13/564375913.db2.gz	DMDUICQGLLLLEM-XMMPIXPASA-N	-2	1	381.475	2.681	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1csnc1C(=O)[O-])c1nc(C(C)(C)C)cs1	ZINC000567797870	564388913	/nfs/dbraw/zinc/38/89/13/564388913.db2.gz	CQLXACFRYMPZAB-SSDOTTSWSA-N	-2	1	375.497	2.635	20	0		GFADML
CCC(CC)c1cc(C[N-]S(=O)(=O)c2sc(C(=O)[O-])cc2OC)on1	ZINC000568623084	564427936	/nfs/dbraw/zinc/42/79/36/564427936.db2.gz	JIWSRUAXZNOGTF-UHFFFAOYSA-N	-2	1	388.467	2.825	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc(CC(=O)[O-])cc2)cc1C(=O)[O-]	ZINC000479280854	564434923	/nfs/dbraw/zinc/43/49/23/564434923.db2.gz	KOAYMOQNTUWXNG-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc([S@](C)=O)cc1	ZINC000479473881	564441462	/nfs/dbraw/zinc/44/14/62/564441462.db2.gz	ZEVJAQXQLKTXHO-QHCPKHFHSA-N	-2	1	387.866	2.885	20	0		GFADML
C[C@H](CCC(=O)[O-])C[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000547891944	564516823	/nfs/dbraw/zinc/51/68/23/564516823.db2.gz	SAHUWIVCYQPESF-ZCFIWIBFSA-N	-2	1	390.708	2.943	20	0		GFADML
C[C@H](CCC[C@@H](C)C(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000547609064	564501577	/nfs/dbraw/zinc/50/15/77/564501577.db2.gz	MPUZBGFPUAQHJS-NXEZZACHSA-N	-2	1	378.834	2.806	20	0		GFADML
O=C([O-])[C@H](Cc1c(F)cccc1Cl)[N-]S(=O)(=O)c1cc(F)ccc1F	ZINC000547613087	564503396	/nfs/dbraw/zinc/50/33/96/564503396.db2.gz	MCFNVNCRXSEBQA-ZDUSSCGKSA-N	-2	1	393.770	2.732	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC[C@H]1C1CC1	ZINC000517072681	564523078	/nfs/dbraw/zinc/52/30/78/564523078.db2.gz	DIHJYHUZZGCSCX-AWEZNQCLSA-N	-2	1	378.475	2.879	20	0		GFADML
O=C([O-])[C@H](Cc1cccc(Cl)c1)[N-]S(=O)(=O)c1cc(F)ccc1F	ZINC000548268288	564546353	/nfs/dbraw/zinc/54/63/53/564546353.db2.gz	KJWFGNPPEYXRHZ-ZDUSSCGKSA-N	-2	1	375.780	2.592	20	0		GFADML
O=C([O-])[C@@H](Cc1ccc(F)cc1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000577598598	564737015	/nfs/dbraw/zinc/73/70/15/564737015.db2.gz	WTJBJDDSHVGTGD-CYBMUJFWSA-N	-2	1	375.780	2.592	20	0		GFADML
C[C@@H]1SCC[C@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000649175453	565751811	/nfs/dbraw/zinc/75/18/11/565751811.db2.gz	UKQGUMYHMMTNIH-GXFFZTMASA-N	-2	1	398.531	2.878	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]C[C@]2(CC(=O)[O-])CC[C@@H](C)C2)c(F)c1	ZINC000681581185	566115870	/nfs/dbraw/zinc/11/58/70/566115870.db2.gz	XSDJLKJGAVVQNO-QLJPJBMISA-N	-2	1	377.409	2.533	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(C(=O)NCCCC(=O)[O-])c2)c1	ZINC000262586735	597274726	/nfs/dbraw/zinc/27/47/26/597274726.db2.gz	GWCCXJIGHGGMRX-UHFFFAOYSA-N	-2	1	390.461	2.699	20	0		GFADML
O=C([O-])[C@@H]1CCCCN1C(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000262685776	597440742	/nfs/dbraw/zinc/44/07/42/597440742.db2.gz	UXYKSEXMRRABGC-KRWDZBQOSA-N	-2	1	388.445	2.567	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])ccc1F	ZINC000728507421	599851113	/nfs/dbraw/zinc/85/11/13/599851113.db2.gz	WCYNGSDBMCTWAM-UHFFFAOYSA-N	-2	1	385.344	2.641	20	0		GFADML
CCCNC(=O)c1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)c1	ZINC000477394775	599905999	/nfs/dbraw/zinc/90/59/99/599905999.db2.gz	FZRMVYLFWOGORZ-UHFFFAOYSA-N	-2	1	376.434	2.634	20	0		GFADML
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2C)c1	ZINC000518564955	600054045	/nfs/dbraw/zinc/05/40/45/600054045.db2.gz	ULKHCKXUPKYRMB-UHFFFAOYSA-N	-2	1	397.474	2.514	20	0		GFADML
CCOCCOCc1cccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])c1	ZINC000737176586	600097875	/nfs/dbraw/zinc/09/78/75/600097875.db2.gz	GKEZMAMMEJHJIT-UHFFFAOYSA-N	-2	1	397.424	2.878	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccc(F)c(NC(=O)[O-])c1	ZINC000737226459	600121880	/nfs/dbraw/zinc/12/18/80/600121880.db2.gz	OHGJHRZKDPHYGO-UHFFFAOYSA-N	-2	1	381.385	2.930	20	0		GFADML
C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736764863	600184333	/nfs/dbraw/zinc/18/43/33/600184333.db2.gz	XFNBZBOBYCLTDU-DDUZABMNSA-N	-2	1	383.448	2.586	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)Nc1ccc(CNC(=O)[O-])cc1	ZINC000738837400	600308782	/nfs/dbraw/zinc/30/87/82/600308782.db2.gz	AJFZKSJXYXYUSV-UHFFFAOYSA-N	-2	1	393.403	2.501	20	0		GFADML
O=C([O-])c1ccccc1S(=O)(=O)[N-]c1cccc(-c2cn3cccnc3n2)c1	ZINC000740243311	600424586	/nfs/dbraw/zinc/42/45/86/600424586.db2.gz	XWLOHQGKJXCNAI-UHFFFAOYSA-N	-2	1	394.412	2.895	20	0		GFADML
COC(=O)CCCOc1ccc([N-]S(=O)(=O)c2ccsc2C(=O)[O-])cc1	ZINC000737596871	600489282	/nfs/dbraw/zinc/48/92/82/600489282.db2.gz	XJHGJGSBXZHJPK-UHFFFAOYSA-N	-2	1	399.446	2.579	20	0		GFADML
O=C([O-])CCOc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000739739981	600545979	/nfs/dbraw/zinc/54/59/79/600545979.db2.gz	ROLDOJPRLIDJBH-UHFFFAOYSA-N	-3	1	399.808	2.693	20	0		GFADML
CC(=O)N1CCc2ccc(S(=O)(=O)[N-]c3ccc(F)c(NC(=O)[O-])c3)cc21	ZINC000736139066	600612676	/nfs/dbraw/zinc/61/26/76/600612676.db2.gz	OVZJJSPMYDJHCJ-UHFFFAOYSA-N	-2	1	393.396	2.625	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc1[N+](=O)[O-]	ZINC000327517152	600637353	/nfs/dbraw/zinc/63/73/53/600637353.db2.gz	QIDXCTCEMIILME-UHFFFAOYSA-N	-2	1	386.769	2.756	20	0		GFADML
O=C([O-])COc1cccc(CNC(=O)c2ccc(Br)cc2[O-])c1	ZINC000739835469	600648618	/nfs/dbraw/zinc/64/86/18/600648618.db2.gz	ZISYTWNHURKOTQ-UHFFFAOYSA-N	-2	1	380.194	2.548	20	0		GFADML
CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc3[nH]nc(C(=O)[O-])c3c2)cc1	ZINC000826668983	600673676	/nfs/dbraw/zinc/67/36/76/600673676.db2.gz	AFZALFKPAJBYDH-UHFFFAOYSA-N	-2	1	387.417	2.901	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(SC)cc2)ccc1C(=O)[O-]	ZINC000831328591	600689420	/nfs/dbraw/zinc/68/94/20/600689420.db2.gz	WDFMOILDPWSDHL-UHFFFAOYSA-N	-2	1	381.431	2.694	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cccc(C(=O)NC(C)(C)CC(=O)[O-])c2)c1	ZINC000738736455	600789496	/nfs/dbraw/zinc/78/94/96/600789496.db2.gz	MTQWZCFMYLHFSK-UHFFFAOYSA-N	-2	1	390.461	2.779	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(N3CCCC3=O)c2)c1	ZINC000740075726	600887795	/nfs/dbraw/zinc/88/77/95/600887795.db2.gz	NUPIHUXMEXABTK-UHFFFAOYSA-N	-2	1	394.836	2.966	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)NC(C)C)cc2)ccc1C(=O)[O-]	ZINC000506731971	600890681	/nfs/dbraw/zinc/89/06/81/600890681.db2.gz	UHPHEZGCQKPNIA-UHFFFAOYSA-N	-2	1	376.434	2.632	20	0		GFADML
COC(=O)NCc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000737638300	600894372	/nfs/dbraw/zinc/89/43/72/600894372.db2.gz	PSBZBWMAOKTYCQ-UHFFFAOYSA-N	-2	1	398.824	2.695	20	0		GFADML
CC(C)c1cnc(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)s1	ZINC000736522373	601084857	/nfs/dbraw/zinc/08/48/57/601084857.db2.gz	FCSDBBBYKFVCRK-UHFFFAOYSA-N	-2	1	386.433	2.625	20	0		GFADML
O=C([O-])c1ccccc1S(=O)(=O)[N-]c1ccc([S@](=O)C(F)(F)F)cc1	ZINC000833335416	601251265	/nfs/dbraw/zinc/25/12/65/601251265.db2.gz	PTZJRWXLMLEDII-DEOSSOPVSA-N	-2	1	393.364	2.813	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccc(/C=C\C(=O)[O-])cc3)c2)no1	ZINC000832991833	601328015	/nfs/dbraw/zinc/32/80/15/601328015.db2.gz	RZZDSBWAKBDJON-YFHOEESVSA-N	-2	1	385.401	2.944	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CCC(=O)N[C@H](C(=O)[O-])C1CCCCC1	ZINC000832993112	601786915	/nfs/dbraw/zinc/78/69/15/601786915.db2.gz	KLCNPUKPBPXRGF-SFHVURJKSA-N	-2	1	398.463	2.635	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)ccc1NC(C)=O	ZINC000832030711	601827883	/nfs/dbraw/zinc/82/78/83/601827883.db2.gz	ZUIDWLQWJKKVOT-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-c3nc[nH]n3)cc2)ccc1Cl	ZINC000735461046	601829850	/nfs/dbraw/zinc/82/98/50/601829850.db2.gz	FZWFVUGTPVYCND-UHFFFAOYSA-N	-2	1	378.797	2.624	20	0		GFADML
Cc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1cc(C(=O)[O-])c(F)cc1Cl	ZINC000063877442	601832204	/nfs/dbraw/zinc/83/22/04/601832204.db2.gz	GDQMSYPBMXNELE-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CCCNC(=O)c1cccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1	ZINC000751145823	601835357	/nfs/dbraw/zinc/83/53/57/601835357.db2.gz	JEVCFCFRXXBGEA-UHFFFAOYSA-N	-2	1	398.387	2.604	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1	ZINC000751145369	601838055	/nfs/dbraw/zinc/83/80/55/601838055.db2.gz	KHSGNGUJARTQEC-UHFFFAOYSA-N	-2	1	399.375	2.605	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc2c(c1)OC(F)(F)O2	ZINC000833293865	601856854	/nfs/dbraw/zinc/85/68/54/601856854.db2.gz	BOJHOWIIKZCYOR-UHFFFAOYSA-N	-2	1	375.280	2.646	20	0		GFADML
O=C([O-])Cc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)c1	ZINC000738630302	601986751	/nfs/dbraw/zinc/98/67/51/601986751.db2.gz	KXIRQDTUSYYZKV-UHFFFAOYSA-N	-2	1	387.772	2.605	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CC(=O)N[C@@H]1CCCCCC[C@@H]1C(=O)[O-]	ZINC000262992332	602052166	/nfs/dbraw/zinc/05/21/66/602052166.db2.gz	SRZYRYJEXUYHJT-DOTOQJQBSA-N	-2	1	398.463	2.635	20	0		GFADML
CCC[C@H](C)c1cc([N-]S(=O)(=O)c2ccc(OCCC(=O)[O-])cc2)[nH]n1	ZINC000829216513	602102547	/nfs/dbraw/zinc/10/25/47/602102547.db2.gz	NLPAKQFIAIRVLI-LBPRGKRZSA-N	-2	1	381.454	2.968	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2cc(CC3CCCCC3)n[nH]2)cc1	ZINC000833259428	602104030	/nfs/dbraw/zinc/10/40/30/602104030.db2.gz	OGSAOIIFIYQVGX-UHFFFAOYSA-N	-2	1	393.465	2.797	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])cc1OC	ZINC000739932759	602245680	/nfs/dbraw/zinc/24/56/80/602245680.db2.gz	LHDGGSLDFDNHAC-UHFFFAOYSA-N	-2	1	378.406	2.545	20	0		GFADML
CCCc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Br)[nH]n1	ZINC000317307092	602305328	/nfs/dbraw/zinc/30/53/28/602305328.db2.gz	BCDPBXKSTVLNOH-UHFFFAOYSA-N	-2	1	388.243	2.624	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(C3CC3)n[nH]2)ccc1Br	ZINC000833304244	602307247	/nfs/dbraw/zinc/30/72/47/602307247.db2.gz	WLMRGPKRQHASCW-UHFFFAOYSA-N	-2	1	386.227	2.549	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(F)c3)cc21	ZINC000533170221	602323102	/nfs/dbraw/zinc/32/31/02/602323102.db2.gz	XKNGYUKPEWQAOP-UHFFFAOYSA-N	-2	1	392.408	2.624	20	0		GFADML
CN(CC(=O)Nc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1)C(=O)[O-]	ZINC000739628157	602568654	/nfs/dbraw/zinc/56/86/54/602568654.db2.gz	VBXGUYVTYLIWQV-UHFFFAOYSA-N	-2	1	397.840	2.689	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@H]2CCCN(C(=O)[O-])C2)c([O-])c1	ZINC000736283535	602864739	/nfs/dbraw/zinc/86/47/39/602864739.db2.gz	KBNHZJGAOYSWIE-LBPRGKRZSA-N	-2	1	379.413	2.611	20	0		GFADML
Cc1csc(N2CCN(C(=O)c3ccc(NC(=O)[O-])cc3[O-])C[C@@H]2C)n1	ZINC000740210403	602867639	/nfs/dbraw/zinc/86/76/39/602867639.db2.gz	VPKDKWSPNZTEBO-NSHDSACASA-N	-2	1	376.438	2.598	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC[C@H]1NC(=O)OC(C)(C)C	ZINC000739167586	602870089	/nfs/dbraw/zinc/87/00/89/602870089.db2.gz	MQKDLGSUGOVBNZ-SMDDNHRTSA-N	-2	1	393.440	2.857	20	0		GFADML
O=C([O-])NC[C@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)C1CC1	ZINC000740614388	603071483	/nfs/dbraw/zinc/07/14/83/603071483.db2.gz	ROOMIHUNFYWNPS-JTQLQIEISA-N	-2	1	387.672	2.971	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])ccc1F	ZINC000738563497	603293776	/nfs/dbraw/zinc/29/37/76/603293776.db2.gz	XKENWJDZSIIFTI-UHFFFAOYSA-N	-2	1	393.396	2.625	20	0		GFADML
C[C@@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000825449585	603400702	/nfs/dbraw/zinc/40/07/02/603400702.db2.gz	UJEKEXQDTJRUIM-SECBINFHSA-N	-3	1	382.369	2.653	20	0		GFADML
O=C([O-])N[C@H](CC(=O)Nc1ccc(-c2cc(=O)[nH][n-]2)cc1)Cc1ccccc1	ZINC000832105538	603474253	/nfs/dbraw/zinc/47/42/53/603474253.db2.gz	OMKXNTWZUYETRV-INIZCTEOSA-N	-2	1	380.404	2.990	20	0		GFADML
CC(C)C[C@H](CNC(=O)[O-])NC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1	ZINC000824192161	603660996	/nfs/dbraw/zinc/66/09/96/603660996.db2.gz	YUOZKEWXWYBSIO-MRXNPFEDSA-N	-2	1	391.468	2.679	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])cc(Cl)c1F	ZINC000767732775	604631703	/nfs/dbraw/zinc/63/17/03/604631703.db2.gz	IRIQPSPBJJRLCR-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCSC[C@H]2CC(=O)[O-])c([O-])c1	ZINC000833442915	604715019	/nfs/dbraw/zinc/71/50/19/604715019.db2.gz	MNBBGDQQEDDCBW-GFCCVEGCSA-N	-2	1	396.465	2.772	20	0		GFADML
CN(C(=O)[O-])c1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)cc1	ZINC000830518365	604767346	/nfs/dbraw/zinc/76/73/46/604767346.db2.gz	AQTWHXYOZARTSS-UHFFFAOYSA-N	-2	1	384.797	2.953	20	0		GFADML
Cc1nnc(-c2cccc([N-]S(=O)(=O)c3cc(C(=O)[O-])ccc3C)c2)n1C	ZINC000370907537	604792232	/nfs/dbraw/zinc/79/22/32/604792232.db2.gz	KHYAJJRAOALACQ-UHFFFAOYSA-N	-2	1	386.433	2.598	20	0		GFADML
Cc1ccc(-c2[nH]nc([N-]S(=O)(=O)c3cc(F)ccc3C(=O)[O-])c2C)o1	ZINC000832906808	604809242	/nfs/dbraw/zinc/80/92/42/604809242.db2.gz	BSUSBJKQXKQPCV-UHFFFAOYSA-N	-2	1	379.369	2.925	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])c(Cl)c1)c1nc(C2CC2)no1	ZINC000563073558	605001723	/nfs/dbraw/zinc/00/17/23/605001723.db2.gz	WQFODAULMDMSSZ-ZDUSSCGKSA-N	-2	1	399.856	2.974	20	0		GFADML
CCC[C@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)cc2)cc1)C(=O)[O-]	ZINC000262129348	605022617	/nfs/dbraw/zinc/02/26/17/605022617.db2.gz	KFSMILAYPYYAQW-KRWDZBQOSA-N	-2	1	390.461	2.779	20	0		GFADML
C[C@H](OC(=O)c1cc(F)cc(Cl)c1[O-])C(=O)NCc1ccc(C(=O)[O-])cc1	ZINC000833531664	605056700	/nfs/dbraw/zinc/05/67/00/605056700.db2.gz	LGHLXBCRDABAEO-VIFPVBQESA-N	-2	1	395.770	2.745	20	0		GFADML
CC(C)C(=O)Nc1cccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)c1	ZINC000485291388	605160786	/nfs/dbraw/zinc/16/07/86/605160786.db2.gz	RWMGCUOGYIUMBO-UHFFFAOYSA-N	-2	1	380.397	2.919	20	0		GFADML
CCc1oc(C(=O)[O-])cc1S(=O)(=O)[N-][C@@H](Cc1ccccc1)C(F)(F)F	ZINC000833684067	605441041	/nfs/dbraw/zinc/44/10/41/605441041.db2.gz	ZAAIRAQYTDQNIX-AWEZNQCLSA-N	-2	1	391.367	2.992	20	0		GFADML
Cc1ccc(C=CS(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)cc1	ZINC000822233171	606622183	/nfs/dbraw/zinc/62/21/83/606622183.db2.gz	IZMYZKFJYGKJKW-KTKRTIGZSA-N	-2	1	387.469	2.539	20	0		GFADML
CN(CC(F)(F)F)C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000097376003	655035078	/nfs/dbraw/zinc/03/50/78/655035078.db2.gz	NAQSKHRITIHNDS-UHFFFAOYSA-N	-2	1	394.396	2.889	20	0		GFADML
O=C([O-])CCC[N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl	ZINC000262362196	655445406	/nfs/dbraw/zinc/44/54/06/655445406.db2.gz	CXTTYDXZYXTLFZ-UHFFFAOYSA-N	-2	1	391.070	2.899	20	0		GFADML
CSCCCNC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000265509169	655484819	/nfs/dbraw/zinc/48/48/19/655484819.db2.gz	FPBJJUCQIIVWMV-UHFFFAOYSA-N	-2	1	386.520	2.737	20	0		GFADML
Cc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1cc(C)c(Cl)c(C(=O)[O-])c1	ZINC000759096839	655947374	/nfs/dbraw/zinc/94/73/74/655947374.db2.gz	LUFWYWKBSDYFIM-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc([S@@](C)=O)c2)cc(C(=O)[O-])c1Cl	ZINC000759097850	655947558	/nfs/dbraw/zinc/94/75/58/655947558.db2.gz	QTWUOQHRMCLLFI-HSZRJFAPSA-N	-2	1	387.866	2.885	20	0		GFADML
CC(C)(C[N-]S(=O)(=O)c1cc(C(=O)[O-])oc1Br)C(F)(F)F	ZINC000800816979	659331855	/nfs/dbraw/zinc/33/18/55/659331855.db2.gz	SVSHOPLGSJZCNU-UHFFFAOYSA-N	-2	1	394.165	2.607	20	0		GFADML
CCC(C)(C)[C@@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000843296490	661376539	/nfs/dbraw/zinc/37/65/39/661376539.db2.gz	MAZLWNKHSSPFDI-VIFPVBQESA-N	-2	1	399.694	2.665	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]CCCCCCC(=O)[O-])c1F	ZINC000846773902	661565617	/nfs/dbraw/zinc/56/56/17/661565617.db2.gz	RVOCEMZTUQHZLJ-UHFFFAOYSA-N	-2	1	395.836	2.579	20	0		GFADML
O=C([O-])C1=CC[C@@H]([N-]S(=O)(=O)c2c(Cl)cc(F)cc2Br)C1	ZINC000853069093	661880432	/nfs/dbraw/zinc/88/04/32/661880432.db2.gz	LOTSNURGDMPAHL-MRVPVSSYSA-N	-2	1	398.637	2.693	20	0		GFADML
CC(C)OC[C@H]([N-]S(=O)(=O)c1sc2ccccc2c1Cl)C(=O)[O-]	ZINC000863416820	662328830	/nfs/dbraw/zinc/32/88/30/662328830.db2.gz	LMUMXMMRMWAKDQ-JTQLQIEISA-N	-2	1	377.871	2.711	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)[N-][C@H]2CCSC3(CC(C(=O)[O-])C3)C2)c(F)c1	ZINC000899950183	663703967	/nfs/dbraw/zinc/70/39/67/663703967.db2.gz	XDMWMSZAMKTHAO-CSJGVYOVSA-N	-2	1	391.461	2.681	20	0		GFADML
CS(=O)(=O)[N-]c1cc(F)ccc1NC(=O)c1cc(F)c([O-])c(Cl)c1	ZINC000195063368	553036820	/nfs/dbraw/zinc/03/68/20/553036820.db2.gz	KKDPBTBPIQHZHS-UHFFFAOYSA-N	-2	1	376.768	2.948	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCCSCC1	ZINC000299241030	563379072	/nfs/dbraw/zinc/37/90/72/563379072.db2.gz	JCOVNGWUOLIXNT-UHFFFAOYSA-N	-2	1	398.531	2.834	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)ccc1Br	ZINC000316933241	563442438	/nfs/dbraw/zinc/44/24/38/563442438.db2.gz	NQEYQZPLRIHHKK-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2ccc(OC(F)F)c(Cl)c2)cc1C(=O)[O-]	ZINC000323872091	563451573	/nfs/dbraw/zinc/45/15/73/563451573.db2.gz	IXJXBEAOSQROPZ-UHFFFAOYSA-N	-2	1	380.756	2.779	20	0		GFADML
COC(=O)c1sccc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1Cl	ZINC000391323797	563524321	/nfs/dbraw/zinc/52/43/21/563524321.db2.gz	QHCFDMXWXFMOMP-UHFFFAOYSA-N	-2	1	375.811	2.687	20	0		GFADML
O=S(=O)([N-]c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1)c1ccco1	ZINC000437678716	563698221	/nfs/dbraw/zinc/69/82/21/563698221.db2.gz	BQPTWCPJYPCIAT-UHFFFAOYSA-N	-2	1	378.431	2.881	20	0		GFADML
O=C([O-])c1cc(Br)cc(S(=O)(=O)[N-]c2ccc3c(c2)COC3)c1	ZINC000506994948	564215180	/nfs/dbraw/zinc/21/51/80/564215180.db2.gz	MKMNMPYQRIXEOM-UHFFFAOYSA-N	-2	1	398.234	2.978	20	0		GFADML
CC(C)(C)[C@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000547595069	564500106	/nfs/dbraw/zinc/50/01/06/564500106.db2.gz	STSIQIZQXIXYSN-SSDOTTSWSA-N	-2	1	390.708	2.942	20	0		GFADML
CC[C@@H](C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)CC(=O)[O-]	ZINC000547611239	564502656	/nfs/dbraw/zinc/50/26/56/564502656.db2.gz	PWSKLLKHDXNPAM-SSDOTTSWSA-N	-2	1	386.214	2.507	20	0		GFADML
O=C([O-])c1cc(Br)ccc1[N-]S(=O)(=O)c1ccc2c(c1)COC2	ZINC000547871440	564514386	/nfs/dbraw/zinc/51/43/86/564514386.db2.gz	DJZJZACFWOCVHP-UHFFFAOYSA-N	-2	1	398.234	2.978	20	0		GFADML
CC[C@@H](C[N-]S(=O)(=O)c1cc(Br)sc1Cl)CC(=O)[O-]	ZINC000547933757	564522872	/nfs/dbraw/zinc/52/28/72/564522872.db2.gz	NUVYOTRFYSEART-ZCFIWIBFSA-N	-2	1	390.708	2.943	20	0		GFADML
Nc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2OC(F)(F)F)cc1	ZINC000548267028	564546392	/nfs/dbraw/zinc/54/63/92/564546392.db2.gz	PCXAXZLLNAOOGC-UHFFFAOYSA-N	-2	1	376.312	2.666	20	0		GFADML
O=C([O-])[C@H](Cc1cccc(Cl)c1)[N-]S(=O)(=O)c1cc(F)c(F)cc1F	ZINC000548570700	564562304	/nfs/dbraw/zinc/56/23/04/564562304.db2.gz	UXNMKLMBAWYFSX-ZDUSSCGKSA-N	-2	1	393.770	2.732	20	0		GFADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])cc1	ZINC000485651490	564621881	/nfs/dbraw/zinc/62/18/81/564621881.db2.gz	VKQCGEBHJFZCQT-UHFFFAOYSA-N	-3	1	383.809	2.856	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)cc1C	ZINC000525521895	564702605	/nfs/dbraw/zinc/70/26/05/564702605.db2.gz	FOAJUVJVDFDCGN-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC1(C)SC[C@@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000555232130	564787453	/nfs/dbraw/zinc/78/74/53/564787453.db2.gz	QYQGLHVJOCUNDL-ZDUSSCGKSA-N	-2	1	398.531	2.878	20	0		GFADML
C[C@H]1SCC[C@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000649175455	565751930	/nfs/dbraw/zinc/75/19/30/565751930.db2.gz	UKQGUMYHMMTNIH-ZWNOBZJWSA-N	-2	1	398.531	2.878	20	0		GFADML
Cc1[n-]n(-c2ccc(S(=O)(=O)[N-]c3nccs3)cc2)c(=O)c1C1CC1	ZINC000634617609	566160444	/nfs/dbraw/zinc/16/04/44/566160444.db2.gz	UBYNHXDEWMEHEC-AWEZNQCLSA-N	-2	1	376.463	2.693	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)cc(C(=O)[O-])c1Cl	ZINC000759100545	597420010	/nfs/dbraw/zinc/42/00/10/597420010.db2.gz	CMUMOMAKISKZRU-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
Cc1nc(C2([N-]S(=O)(=O)c3ccc(C(=O)[O-])cc3Cl)CCCCC2)no1	ZINC000738851087	599726050	/nfs/dbraw/zinc/72/60/50/599726050.db2.gz	WQSCCOHEKZIZTB-UHFFFAOYSA-N	-2	1	399.856	2.868	20	0		GFADML
CC(C)COC[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1F)c1ccco1	ZINC000736445191	599731676	/nfs/dbraw/zinc/73/16/76/599731676.db2.gz	CNROYMGXEWGBFU-CQSZACIVSA-N	-2	1	385.413	2.809	20	0		GFADML
CCCC[C@H]1CCC[C@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736986123	599767300	/nfs/dbraw/zinc/76/73/00/599767300.db2.gz	UBPAIOPDFYYSDU-KBXCAEBGSA-N	-2	1	385.464	2.881	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1Cl)c1nc(C2CC2)no1	ZINC000736388653	599775228	/nfs/dbraw/zinc/77/52/28/599775228.db2.gz	BMRJIFOERPIFLF-CYBMUJFWSA-N	-2	1	399.856	2.974	20	0		GFADML
CC(=O)N1CCCc2cc([N-]S(=O)(=O)c3cccc(C(=O)[O-])c3C)ccc21	ZINC000268577979	599907209	/nfs/dbraw/zinc/90/72/09/599907209.db2.gz	DHOCJKQOEGBBHM-UHFFFAOYSA-N	-2	1	388.445	2.793	20	0		GFADML
Cc1cc(C(=O)NC(C)C)ccc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000477431323	599907567	/nfs/dbraw/zinc/90/75/67/599907567.db2.gz	LKVXLOBXKDOVBK-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
CC(C)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736396514	599952477	/nfs/dbraw/zinc/95/24/77/599952477.db2.gz	WJJZQTVSTFKZJH-ROUUACIJSA-N	-2	1	385.464	2.737	20	0		GFADML
CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2cc(OC)ccc2C(=O)[O-])cc1	ZINC000494620593	600005582	/nfs/dbraw/zinc/00/55/82/600005582.db2.gz	YBNVAHGSDDYCGZ-UHFFFAOYSA-N	-2	1	378.406	2.543	20	0		GFADML
O=C([O-])[C@H]1C[C@H]1C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1	ZINC000485468875	600102106	/nfs/dbraw/zinc/10/21/06/600102106.db2.gz	VILMLPAYAJGVRZ-CABCVRRESA-N	-2	1	394.836	2.800	20	0		GFADML
COc1cc(F)c([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)cc1OC	ZINC000730436124	600139297	/nfs/dbraw/zinc/13/92/97/600139297.db2.gz	JWWUVQDLVAFKRS-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c([N+](=O)[O-])c2)cc1C(=O)[O-]	ZINC000042122881	600541143	/nfs/dbraw/zinc/54/11/43/600541143.db2.gz	QDGRECFWZIVIBC-UHFFFAOYSA-N	-2	1	386.769	2.756	20	0		GFADML
C[S@@](=O)Cc1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])c1	ZINC000738180253	600612694	/nfs/dbraw/zinc/61/26/94/600612694.db2.gz	UFDRVDHUANQFSF-HSZRJFAPSA-N	-2	1	387.866	2.718	20	0		GFADML
CC(=O)Nc1c(C)ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)c1C	ZINC000673982496	600628179	/nfs/dbraw/zinc/62/81/79/600628179.db2.gz	RISTYZDHVWJEKM-UHFFFAOYSA-N	-2	1	376.434	2.690	20	0		GFADML
Cc1cc(C(=O)NC(C)C)ccc1[N-]S(=O)(=O)c1ccc(CC(=O)[O-])cc1	ZINC000481984836	600628377	/nfs/dbraw/zinc/62/83/77/600628377.db2.gz	WKUYENMKUOKJJS-UHFFFAOYSA-N	-2	1	390.461	2.561	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)Nc1cc(Cl)cc(C(=O)[O-])c1	ZINC000738992773	600636739	/nfs/dbraw/zinc/63/67/39/600636739.db2.gz	FZLIWPBFFGSVFL-UHFFFAOYSA-N	-2	1	375.811	2.907	20	0		GFADML
O=C([O-])CSCc1cccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2F)c1	ZINC000833263318	600682014	/nfs/dbraw/zinc/68/20/14/600682014.db2.gz	LXPZOAGIWLCGPS-UHFFFAOYSA-N	-2	1	399.421	2.643	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(Cl)ccc2C)ccc1C(=O)[O-]	ZINC000831327385	600688916	/nfs/dbraw/zinc/68/89/16/600688916.db2.gz	KEWJSMIBKHWKPT-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])CCOc1ccc(S(=O)(=O)[N-]c2cc(F)c(F)c(F)c2)cc1	ZINC000327335293	600784140	/nfs/dbraw/zinc/78/41/40/600784140.db2.gz	IAJAAKBTSCFALW-UHFFFAOYSA-N	-2	1	375.324	2.758	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc(OC)c1OC	ZINC000013348732	600807862	/nfs/dbraw/zinc/80/78/62/600807862.db2.gz	VHPXNSHHSZDBJI-UHFFFAOYSA-N	-2	1	381.406	2.520	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)Nc1ccc(C(C)(C)C(=O)[O-])cc1	ZINC000738874359	600933995	/nfs/dbraw/zinc/93/39/95/600933995.db2.gz	JYQMXDOWVILANT-UHFFFAOYSA-N	-2	1	396.447	2.985	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CC[C@H]3c3cccc(F)c3)cc2)[n-]1	ZINC000833264983	600934404	/nfs/dbraw/zinc/93/44/04/600934404.db2.gz	OGSZSMAHVUUNPH-SFHVURJKSA-N	-2	1	395.390	2.519	20	0		GFADML
C[C@@H]1CN(c2ccc([N-]S(=O)(=O)c3csc(C(=O)[O-])c3)cc2)C[C@@H](C)O1	ZINC000747407975	600980362	/nfs/dbraw/zinc/98/03/62/600980362.db2.gz	KDVQFUFIFYRFEO-VXGBXAGGSA-N	-2	1	396.490	2.861	20	0		GFADML
COc1ccc(-c2cc3[n-]c(CN4CCC[C@H](C(=O)[O-])C4)nc(=O)c3s2)cc1	ZINC000737910355	601034423	/nfs/dbraw/zinc/03/44/23/601034423.db2.gz	ZXIKDRKFIXIWAV-ZDUSSCGKSA-N	-2	1	399.472	2.957	20	0		GFADML
COc1cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(C)c2)c(Cl)cc1C(=O)[O-]	ZINC000485272068	601224051	/nfs/dbraw/zinc/22/40/51/601224051.db2.gz	MVYQRPBXQQLRBS-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
COC[C@@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F	ZINC000831585385	601267405	/nfs/dbraw/zinc/26/74/05/601267405.db2.gz	MVYDZCGBMXCQJW-GFCCVEGCSA-N	-2	1	389.779	2.517	20	0		GFADML
CCC(CC)(CC(=O)[O-])NC(=O)CCc1c(C)nc(-c2cccnc2)[n-]c1=O	ZINC000828780241	601306198	/nfs/dbraw/zinc/30/61/98/601306198.db2.gz	YBXVGJKBKMARKE-UHFFFAOYSA-N	-2	1	386.452	2.635	20	0		GFADML
COC(=O)/C=C\c1ccc(S(=O)(=O)[N-]c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000747605211	601320579	/nfs/dbraw/zinc/32/05/79/601320579.db2.gz	XZJAQMSZWXJWPC-WTKPLQERSA-N	-2	1	379.365	2.511	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000614818528	601323258	/nfs/dbraw/zinc/32/32/58/601323258.db2.gz	MNBZTEYHPWEFFD-UHFFFAOYSA-N	-2	1	390.461	2.861	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc3c(c2)CCC(=O)N3C)c1C	ZINC000517156838	601329765	/nfs/dbraw/zinc/32/97/65/601329765.db2.gz	RAQIVPYWVIPPNK-UHFFFAOYSA-N	-2	1	388.445	2.711	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2cccc(C[S@@](C)=O)c2C)c1C	ZINC000265246237	601331026	/nfs/dbraw/zinc/33/10/26/601331026.db2.gz	IEECCIPYBRFZIC-RUZDIDTESA-N	-2	1	395.502	2.989	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1csc(C(=O)[O-])c1)c1nc(C2CCCCC2)no1	ZINC000827767757	601384857	/nfs/dbraw/zinc/38/48/57/601384857.db2.gz	KAGPNFRDWXUXNN-SECBINFHSA-N	-2	1	385.467	2.917	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])s1)c1nc(C2CCCCC2)no1	ZINC000827755240	601385109	/nfs/dbraw/zinc/38/51/09/601385109.db2.gz	OMAPNGGIFAECNM-VIFPVBQESA-N	-2	1	385.467	2.917	20	0		GFADML
CC[C@](C)(CC(=O)[O-])NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000767050163	601460212	/nfs/dbraw/zinc/46/02/12/601460212.db2.gz	ATRXQGWDVVMYHO-LJQANCHMSA-N	-2	1	390.461	2.861	20	0		GFADML
CC[C@](C)(CC(=O)[O-])NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000767052316	601468651	/nfs/dbraw/zinc/46/86/51/601468651.db2.gz	SEQLXOKWTXLQTO-LJQANCHMSA-N	-2	1	390.461	2.861	20	0		GFADML
CN(C)C(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000025766774	601826514	/nfs/dbraw/zinc/82/65/14/601826514.db2.gz	MGNSFZYVULYFMC-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
Cc1cc(C)c([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c(C(=O)[O-])c1	ZINC000751142723	601839291	/nfs/dbraw/zinc/83/92/91/601839291.db2.gz	LHDLGEPHUROJSU-UHFFFAOYSA-N	-3	1	385.344	2.779	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)cc(F)c1F	ZINC000831348501	601841183	/nfs/dbraw/zinc/84/11/83/601841183.db2.gz	VNRVLGNXMMWAHZ-UHFFFAOYSA-N	-2	1	399.371	2.569	20	0		GFADML
CC(C)c1cc([N-]S(=O)(=O)c2ccc(Br)cc2C(=O)[O-])[nH]n1	ZINC000827111977	601850500	/nfs/dbraw/zinc/85/05/00/601850500.db2.gz	CLAWPFIFVAHCIB-UHFFFAOYSA-N	-2	1	388.243	2.795	20	0		GFADML
CC[C@@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000828758736	601859391	/nfs/dbraw/zinc/85/93/91/601859391.db2.gz	OAZUPQAQMIVRGM-LLVKDONJSA-N	-2	1	394.424	2.853	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])oc1Br)c1nccs1	ZINC000096742948	602157749	/nfs/dbraw/zinc/15/77/49/602157749.db2.gz	DXUHYSFKJFAXLG-ZCFIWIBFSA-N	-2	1	395.256	2.626	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(NC(=O)CN(C)C(=O)[O-])ccc2C)c1	ZINC000740174008	602159928	/nfs/dbraw/zinc/15/99/28/602159928.db2.gz	ZUEOHURWMDIODH-UHFFFAOYSA-N	-2	1	391.449	2.653	20	0		GFADML
CCOC(=O)c1ccc(S(=O)(=O)[N-][C@H](c2ccccc2)C(C)(C)C(=O)[O-])o1	ZINC000829881671	602217863	/nfs/dbraw/zinc/21/78/63/602217863.db2.gz	SMMCRWPALLIEIN-OAHLLOKOSA-N	-2	1	395.433	2.587	20	0		GFADML
Cc1oc(S(=O)(=O)[N-]c2cc(CCc3ccccc3)[nH]n2)cc1C(=O)[O-]	ZINC000833027844	602306719	/nfs/dbraw/zinc/30/67/19/602306719.db2.gz	YTSYCBNRFQPTFL-UHFFFAOYSA-N	-2	1	375.406	2.595	20	0		GFADML
O=C([O-])c1ccc(Br)c(S(=O)(=O)[N-]c2cc(C3CC3)n[nH]2)c1	ZINC000833309673	602307159	/nfs/dbraw/zinc/30/71/59/602307159.db2.gz	DWYWWAZNNPPLOK-UHFFFAOYSA-N	-2	1	386.227	2.549	20	0		GFADML
COC(=O)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cc(C)ccc1Cl	ZINC000831471857	602320967	/nfs/dbraw/zinc/32/09/67/602320967.db2.gz	XNPBEUAZJKTKPH-UHFFFAOYSA-N	-2	1	389.838	2.996	20	0		GFADML
CC(C)[C@H](NC(=O)[O-])C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000736381413	602395003	/nfs/dbraw/zinc/39/50/03/602395003.db2.gz	LICQPYQLXFMEMR-INIZCTEOSA-N	-2	1	391.449	2.718	20	0		GFADML
CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738718545	602852309	/nfs/dbraw/zinc/85/23/09/602852309.db2.gz	YJSHXVVDTBERGD-GFCCVEGCSA-N	-2	1	379.413	2.611	20	0		GFADML
C[C@@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1ccc(N2CCOC2=O)cc1	ZINC000739026011	602854136	/nfs/dbraw/zinc/85/41/36/602854136.db2.gz	WFWQJLHWSOMVPB-LLVKDONJSA-N	-2	1	385.376	2.930	20	0		GFADML
Cc1nc(-c2ccc(NC[C@@H]3[C@H](C)OC(C)(C)N3C(=O)[O-])nc2)[n-]c(=O)c1C	ZINC000830685617	604019978	/nfs/dbraw/zinc/01/99/78/604019978.db2.gz	ITAVDOJXZQZBAM-GXTWGEPZSA-N	-2	1	387.440	2.776	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCN(c3cc(F)ccc3F)CC2)c([O-])c1	ZINC000832829249	604069339	/nfs/dbraw/zinc/06/93/39/604069339.db2.gz	QJBKLSHIVGZNOP-UHFFFAOYSA-N	-2	1	377.347	2.723	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1cccc2c1CCN2C(=O)[O-]	ZINC000829854496	604316216	/nfs/dbraw/zinc/31/62/16/604316216.db2.gz	JHZWPCSSJZEODJ-UHFFFAOYSA-N	-3	1	376.390	2.535	20	0		GFADML
COc1ccccc1[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])o1)c1ccco1	ZINC000832597413	604364126	/nfs/dbraw/zinc/36/41/26/604364126.db2.gz	XCGGFCRXNQNJIH-INIZCTEOSA-N	-2	1	377.374	2.647	20	0		GFADML
CC(C)CC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])nc2)cc1	ZINC000833474814	604687179	/nfs/dbraw/zinc/68/71/79/604687179.db2.gz	YFZUNIGZOQFABE-UHFFFAOYSA-N	-2	1	377.422	2.565	20	0		GFADML
COc1ccc2oc([C@H](C)[N-]S(=O)(=O)c3csnc3C(=O)[O-])c(C)c2c1	ZINC000566175877	605025557	/nfs/dbraw/zinc/02/55/57/605025557.db2.gz	GMHNJKFROWCKLH-VIFPVBQESA-N	-2	1	396.446	2.944	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1[N+](=O)[O-]	ZINC000327098982	605166919	/nfs/dbraw/zinc/16/69/19/605166919.db2.gz	XDWHMTNYOWHYNB-UHFFFAOYSA-N	-2	1	386.769	2.756	20	0		GFADML
O=C([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(C(=O)NC2CC2)c1	ZINC000833766448	605169875	/nfs/dbraw/zinc/16/98/75/605169875.db2.gz	QYVOTUCHGHBWFF-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
O=C([O-])CCOc1ccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2)cc1	ZINC000833775017	605190884	/nfs/dbraw/zinc/19/08/84/605190884.db2.gz	RVQRETZLQRIGSC-UHFFFAOYSA-N	-2	1	388.401	2.996	20	0		GFADML
CC(C)COC[C@H]([N-]S(=O)(=O)c1cc(F)cc(C(=O)[O-])c1)c1ccco1	ZINC000833487739	605199725	/nfs/dbraw/zinc/19/97/25/605199725.db2.gz	GQKWGHKHRDZJCK-HNNXBMFYSA-N	-2	1	385.413	2.809	20	0		GFADML
O=C([O-])N[C@@H](CNC(=O)c1ccc(Br)c([O-])c1)c1ccccc1	ZINC000834146390	605936642	/nfs/dbraw/zinc/93/66/42/605936642.db2.gz	IBFNQDWVRJBDSH-ZDUSSCGKSA-N	-2	1	379.210	2.893	20	0		GFADML
O=C([O-])N1CCC2(CCN(C(=O)c3ccc(Br)c([O-])c3)C2)CC1	ZINC000834091709	605938498	/nfs/dbraw/zinc/93/84/98/605938498.db2.gz	YIJMMZXOJPEWHE-UHFFFAOYSA-N	-2	1	383.242	2.761	20	0		GFADML
O=C([O-])N1CCC(CCC(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)CC1	ZINC000834288861	606070472	/nfs/dbraw/zinc/07/04/72/606070472.db2.gz	ZUPQDRXPLFEHEL-UHFFFAOYSA-N	-2	1	388.464	2.984	20	0		GFADML
CS(=O)(=O)[N-]c1nnc([N-]C(=O)c2ccc(Oc3ccccc3)o2)s1	ZINC000482126345	647892498	/nfs/dbraw/zinc/89/24/98/647892498.db2.gz	WUJRJOOJXSSIDW-UHFFFAOYSA-N	-2	1	380.407	2.547	20	0		GFADML
O=C(NOC1CCCC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000272093972	655102577	/nfs/dbraw/zinc/10/25/77/655102577.db2.gz	JZKUMRYCGOICLR-UHFFFAOYSA-N	-2	1	382.463	2.859	20	0		GFADML
O=C([O-])Cc1cccc(S(=O)(=O)[N-]c2ccc(OC(F)F)c(F)c2)c1	ZINC000580020710	655506764	/nfs/dbraw/zinc/50/67/64/655506764.db2.gz	YUGZESDCDIKSFW-UHFFFAOYSA-N	-2	1	375.324	2.855	20	0		GFADML
O=C([O-])CCCc1nnc(NC(=O)c2cc(Br)ccc2[O-])s1	ZINC000739711684	655694350	/nfs/dbraw/zinc/69/43/50/655694350.db2.gz	NQHMPGPYBORGGV-UHFFFAOYSA-N	-2	1	386.227	2.666	20	0		GFADML
COc1cc(Br)c(S(=O)(=O)[N-]c2ccccc2)cc1C(=O)[O-]	ZINC000772861607	656392084	/nfs/dbraw/zinc/39/20/84/656392084.db2.gz	NKPVYRSXCPIOGK-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
CC(C)(C)C[C@@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000776552359	656756684	/nfs/dbraw/zinc/75/66/84/656756684.db2.gz	QQPVDOUGJJMILN-MRVPVSSYSA-N	-2	1	399.694	2.665	20	0		GFADML
C[C@H](C[N-]S(=O)(=O)c1sc(C(=O)[O-])cc1Br)CC(F)F	ZINC000843288041	661375915	/nfs/dbraw/zinc/37/59/15/661375915.db2.gz	JNYDUBLOOKYVSQ-YFKPBYRVSA-N	-2	1	392.243	2.778	20	0		GFADML
COc1cc(Cl)ccc1S(=O)(=O)[N-]N=c1c(F)c(F)[n-]c(F)c1F	ZINC000844254425	661411790	/nfs/dbraw/zinc/41/17/90/661411790.db2.gz	RZHMTJYSOWLERA-UHFFFAOYSA-N	-2	1	385.726	2.605	20	0		GFADML
CCC[C@H](C(=O)OCC)S(=O)(=O)[N-]c1cc(C)cc(Br)c1[O-]	ZINC000844660157	661432738	/nfs/dbraw/zinc/43/27/38/661432738.db2.gz	OBJBXYADXPMKDT-GFCCVEGCSA-N	-2	1	394.287	2.937	20	0		GFADML
CCC[C@@H](C(=O)OCC)S(=O)(=O)[N-]c1ccc(S[C@H](C)C(=O)[O-])cc1	ZINC000844662120	661432758	/nfs/dbraw/zinc/43/27/58/661432758.db2.gz	MBABBNPDVZYSNE-RISCZKNCSA-N	-2	1	389.495	2.725	20	0		GFADML
CCc1nnc(C[N-]S(=O)(=O)c2cc(C(=O)[O-])c(Cl)cc2Cl)s1	ZINC000391814111	677409592	/nfs/dbraw/zinc/40/95/92/677409592.db2.gz	UGJUSLHFMZLBBH-UHFFFAOYSA-N	-2	1	396.277	2.584	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]CCCC(F)(F)F)c(Br)s1	ZINC000130303163	551362536	/nfs/dbraw/zinc/36/25/36/551362536.db2.gz	DAVZEJMJBNKLOL-UHFFFAOYSA-N	-2	1	396.206	2.830	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cl)c(C(=O)[O-])c1	ZINC000320611121	563446925	/nfs/dbraw/zinc/44/69/25/563446925.db2.gz	ZXKOFLCVIUHSEA-UHFFFAOYSA-N	-3	1	375.811	2.907	20	0		GFADML
Cc1noc(C(C)(C)[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2Cl)n1	ZINC000284063404	563463007	/nfs/dbraw/zinc/46/30/07/563463007.db2.gz	QANHASKFLWUDRR-UHFFFAOYSA-N	-2	1	394.236	2.597	20	0		GFADML
Cc1cc(Br)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(O)c2)c1	ZINC000436948713	563685436	/nfs/dbraw/zinc/68/54/36/563685436.db2.gz	KLEQPYNINYXYEF-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
CSc1cccc(S(=O)(=O)[N-]c2cc3c(c(C(=O)[O-])c2)OCCO3)c1	ZINC000509084922	564281838	/nfs/dbraw/zinc/28/18/38/564281838.db2.gz	SALPVSUTWPTDLI-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2)c(Br)c1	ZINC000475812679	564320934	/nfs/dbraw/zinc/32/09/34/564320934.db2.gz	JNDKQUTWLHGHQS-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)[O-])c(Br)c1	ZINC000475816990	564321882	/nfs/dbraw/zinc/32/18/82/564321882.db2.gz	VXBQQEYKDGQXAF-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COc1cc(Br)cc(S(=O)(=O)[N-]c2ccccc2C(=O)[O-])c1	ZINC000544847296	564400938	/nfs/dbraw/zinc/40/09/38/564400938.db2.gz	MWZLWTRITLUKBO-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COc1cc(F)c([N-]S(=O)(=O)c2cc(C)cc(C(=O)[O-])c2F)cc1F	ZINC000512743453	564409479	/nfs/dbraw/zinc/40/94/79/564409479.db2.gz	XFBSPCDASZHCLT-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000479277546	564434737	/nfs/dbraw/zinc/43/47/37/564434737.db2.gz	YUONOXOAPVXYFI-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc(CC(=O)[O-])cc1	ZINC000546535003	564457907	/nfs/dbraw/zinc/45/79/07/564457907.db2.gz	NZPZRLSDHQBDDW-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
Cc1nc(CCC[N-]S(=O)(=O)c2c(F)cccc2Cl)sc1C(=O)[O-]	ZINC000548206273	564536782	/nfs/dbraw/zinc/53/67/82/564536782.db2.gz	SIYIQVVXWZLJEE-UHFFFAOYSA-N	-2	1	392.861	2.853	20	0		GFADML
O=C([O-])CC1(C[N-]S(=O)(=O)c2cc(Br)c(F)cc2F)CCC1	ZINC000548591965	564565712	/nfs/dbraw/zinc/56/57/12/564565712.db2.gz	KASOSFFJTFBCAC-UHFFFAOYSA-N	-2	1	398.225	2.651	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(C(=O)[O-])c2)cc1Cl	ZINC000484518871	564590043	/nfs/dbraw/zinc/59/00/43/564590043.db2.gz	IUXMOCIXQCRNIW-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1nc(CCC[N-]S(=O)(=O)c2cc(Cl)ccc2F)sc1C(=O)[O-]	ZINC000581433044	564802765	/nfs/dbraw/zinc/80/27/65/564802765.db2.gz	UKAORNTXMWUBIR-UHFFFAOYSA-N	-2	1	392.861	2.853	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc3ncsc3c2)ccc1OCC(=O)[O-]	ZINC000500300052	564949965	/nfs/dbraw/zinc/94/99/65/564949965.db2.gz	BKULLOLYGWSPAD-UHFFFAOYSA-N	-2	1	378.431	2.869	20	0		GFADML
Cc1nc(S(=O)(=O)[N-][C@@H](CC(F)(F)F)C(=O)[O-])c(-c2ccccc2)s1	ZINC000663286291	565406608	/nfs/dbraw/zinc/40/66/08/565406608.db2.gz	QFLNMKHYHVWPQZ-JTQLQIEISA-N	-2	1	394.396	2.802	20	0		GFADML
Cc1nc(C2([N-]S(=O)(=O)c3ccsc3C(=O)[O-])CCCCCC2)no1	ZINC000642333499	565411137	/nfs/dbraw/zinc/41/11/37/565411137.db2.gz	CVOKUPIPDMIOGB-UHFFFAOYSA-N	-2	1	385.467	2.666	20	0		GFADML
COc1cc(C(=O)[O-])sc1S(=O)(=O)[N-]CC(F)(F)c1ccccc1C	ZINC000663429886	565420001	/nfs/dbraw/zinc/42/00/01/565420001.db2.gz	JXVDGOIGNDEGEC-UHFFFAOYSA-N	-2	1	391.417	2.834	20	0		GFADML
Cc1cnn(-c2ccc([N-]S(=O)(=O)c3csc(C(=O)[O-])c3)cc2F)c1	ZINC000605496571	565952630	/nfs/dbraw/zinc/95/26/30/565952630.db2.gz	YNDHMDOCXQDNCA-UHFFFAOYSA-N	-2	1	381.410	2.880	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H]2CCCC[C@H]2CCC(=O)[O-])c(F)c1	ZINC000654779530	566022078	/nfs/dbraw/zinc/02/20/78/566022078.db2.gz	QADHOSHGYZMIJP-IINYFYTJSA-N	-2	1	377.409	2.675	20	0		GFADML
O=C([O-])C1(NC(=O)c2cc(NC(=O)OCC(F)(F)F)ccc2[O-])CCCC1	ZINC000821466059	598144579	/nfs/dbraw/zinc/14/45/79/598144579.db2.gz	BQSHZGPKXJPRPP-UHFFFAOYSA-N	-2	1	390.314	2.630	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)NCCCCC(=O)[O-])cc1	ZINC000262458708	598165207	/nfs/dbraw/zinc/16/52/07/598165207.db2.gz	WVJJRFYGHBPJGG-UHFFFAOYSA-N	-2	1	390.461	2.781	20	0		GFADML
CCSc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(-c2nn[n-]n2)nc1	ZINC000736665070	598283229	/nfs/dbraw/zinc/28/32/29/598283229.db2.gz	FERAMQMJNGGDDX-UHFFFAOYSA-N	-2	1	396.885	2.828	20	0		GFADML
CCCC[C@H]1CCC[C@@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736986125	599767157	/nfs/dbraw/zinc/76/71/57/599767157.db2.gz	UBPAIOPDFYYSDU-KSSFIOAISA-N	-2	1	385.464	2.881	20	0		GFADML
Cc1cccc2c1CC[C@H]2NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000738747972	599775091	/nfs/dbraw/zinc/77/50/91/599775091.db2.gz	MXEAMSRXFTUILO-LJQANCHMSA-N	-2	1	391.427	2.518	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(C(=O)NC[C@@H](C)C(=O)[O-])cc2)c1	ZINC000655559883	599779999	/nfs/dbraw/zinc/77/99/99/599779999.db2.gz	CFXJVPRTHXZDCG-CQSZACIVSA-N	-2	1	390.461	2.555	20	0		GFADML
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3cccc(F)c3C(=O)[O-])cc2C[C@H]1C	ZINC000060838276	599851291	/nfs/dbraw/zinc/85/12/91/599851291.db2.gz	HFILDGFLBVNJPJ-SNVBAGLBSA-N	-2	1	392.408	2.622	20	0		GFADML
CCCNC(=O)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)cc1	ZINC000477391599	599907217	/nfs/dbraw/zinc/90/72/17/599907217.db2.gz	IWZFJEYXWZCMOI-UHFFFAOYSA-N	-2	1	376.434	2.634	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2ccc(OC)c3ncccc23)c1	ZINC000516672405	600005835	/nfs/dbraw/zinc/00/58/35/600005835.db2.gz	ZXEKLQVEJIRCOV-UHFFFAOYSA-N	-2	1	388.401	2.751	20	0		GFADML
O=C([O-])Nc1cc([N-]S(=O)(=O)c2ccc(N3CCCC3=O)cc2)ccc1F	ZINC000740012650	600101677	/nfs/dbraw/zinc/10/16/77/600101677.db2.gz	QEPQXDXWMQESTE-UHFFFAOYSA-N	-2	1	393.396	2.843	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cccs1)c1nc(-c2ccc(C(=O)[O-])cc2)no1	ZINC000736671810	600112266	/nfs/dbraw/zinc/11/22/66/600112266.db2.gz	YWPJYBFITLUDLC-SECBINFHSA-N	-2	1	379.419	2.536	20	0		GFADML
CC(C)(C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000267122895	600626416	/nfs/dbraw/zinc/62/64/16/600626416.db2.gz	BCYXEOXMAVDVQZ-UHFFFAOYSA-N	-2	1	390.461	2.643	20	0		GFADML
CCOC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000737145318	600627146	/nfs/dbraw/zinc/62/71/46/600627146.db2.gz	ACKACDCTOPDFLJ-UHFFFAOYSA-N	-2	1	378.406	2.683	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1C(=O)NC(C)C	ZINC000267248149	600629084	/nfs/dbraw/zinc/62/90/84/600629084.db2.gz	ZGSLSFWUPKHWOA-UHFFFAOYSA-N	-2	1	390.461	2.561	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)ccc1C	ZINC000736160416	600635560	/nfs/dbraw/zinc/63/55/60/600635560.db2.gz	FBONCPGACJWJEO-UHFFFAOYSA-N	-2	1	377.422	2.522	20	0		GFADML
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000738342701	600637834	/nfs/dbraw/zinc/63/78/34/600637834.db2.gz	OVHVPEIQZDCBPF-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
O=C([O-])c1ccc(Cl)c(S(=O)(=O)[N-]c2cc(F)cc(C(=O)[O-])c2F)c1	ZINC000740133770	600678957	/nfs/dbraw/zinc/67/89/57/600678957.db2.gz	DAGHMZCOVLADBN-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
CCN(CC)C(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc1	ZINC000013361220	600808476	/nfs/dbraw/zinc/80/84/76/600808476.db2.gz	RVXHECNXTMSJQF-UHFFFAOYSA-N	-2	1	390.461	2.976	20	0		GFADML
O=C([O-])c1ccsc1N1CC[C@H](NC(=O)c2cc3ccccc3cc2[O-])C1=O	ZINC000833131126	601075712	/nfs/dbraw/zinc/07/57/12/601075712.db2.gz	OFCWMRQLBQSJIF-HNNXBMFYSA-N	-2	1	396.424	2.840	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)c1	ZINC000477410718	601234721	/nfs/dbraw/zinc/23/47/21/601234721.db2.gz	GULDHQSUSKQYFI-UHFFFAOYSA-N	-2	1	379.434	2.909	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])cc1C(=O)N(C)C	ZINC000832950338	601251043	/nfs/dbraw/zinc/25/10/43/601251043.db2.gz	KHRJWPGFDYLGTP-UHFFFAOYSA-N	-2	1	376.434	2.504	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1C	ZINC000831453506	601322144	/nfs/dbraw/zinc/32/21/44/601322144.db2.gz	RNBIQPZNRHEAIS-FLIBITNWSA-N	-2	1	375.402	2.680	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c(C)c1	ZINC000829803831	601325961	/nfs/dbraw/zinc/32/59/61/601325961.db2.gz	KCIIFEAHIMJVJE-WDZFZDKYSA-N	-2	1	388.445	2.643	20	0		GFADML
CCc1oc(C(=O)[O-])cc1COC(=O)c1ccc(S(=O)(=O)[N-]C(C)(C)C)o1	ZINC000830390989	601462310	/nfs/dbraw/zinc/46/23/10/601462310.db2.gz	SQACVHGDAOLTNI-UHFFFAOYSA-N	-2	1	399.421	2.567	20	0		GFADML
COc1cc(C(=O)[O-])sc1S(=O)(=O)[N-]c1cc(-c2ccccc2C)n[nH]1	ZINC000831939336	601604730	/nfs/dbraw/zinc/60/47/30/601604730.db2.gz	IFOOLZBVARXDLD-UHFFFAOYSA-N	-2	1	393.446	2.954	20	0		GFADML
C[S@](=O)Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000734416225	601829321	/nfs/dbraw/zinc/82/93/21/601829321.db2.gz	QAQHNXKOOCNQSM-QHCPKHFHSA-N	-2	1	387.866	2.718	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)OC(F)(F)O3)cc(F)c1F	ZINC000751146567	601832119	/nfs/dbraw/zinc/83/21/19/601832119.db2.gz	NYOYXANUAMEAJG-UHFFFAOYSA-N	-2	1	393.270	2.785	20	0		GFADML
Cc1cc(F)cc(C(=O)[O-])c1[N-]S(=O)(=O)c1cc(F)c(F)c(C(=O)[O-])c1	ZINC000832887589	601838992	/nfs/dbraw/zinc/83/89/92/601838992.db2.gz	OEBKZSNVGALUPO-UHFFFAOYSA-N	-3	1	389.307	2.610	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2cccc(Nc3cnn(C)c3)c2)cc1C(=O)[O-]	ZINC000469949196	601882337	/nfs/dbraw/zinc/88/23/37/601882337.db2.gz	BCUIRRWAYTVWKF-UHFFFAOYSA-N	-2	1	386.433	2.971	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1cccc(CSCC(=O)[O-])c1	ZINC000832852671	601984783	/nfs/dbraw/zinc/98/47/83/601984783.db2.gz	FQKDPPYJOFEQOQ-UHFFFAOYSA-N	-3	1	395.458	2.812	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1sccc1Br)[C@@H]1CCCN(C(=O)[O-])C1	ZINC000739036347	601991638	/nfs/dbraw/zinc/99/16/38/601991638.db2.gz	DJFXVORAJLHMQY-RKDXNWHRSA-N	-2	1	397.316	2.567	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])ccc1Cl	ZINC000740715543	602246254	/nfs/dbraw/zinc/24/62/54/602246254.db2.gz	DZMQPGPFZYGBHH-UHFFFAOYSA-N	-3	1	396.808	2.880	20	0		GFADML
CC(C)(CNC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000738752050	602317027	/nfs/dbraw/zinc/31/70/27/602317027.db2.gz	IXAVMAGOZDAXAE-UHFFFAOYSA-N	-2	1	375.661	2.971	20	0		GFADML
CC(C)C[C@H]1CCCN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000826831811	602322201	/nfs/dbraw/zinc/32/22/01/602322201.db2.gz	HNNQVQMIEKFHRJ-OAHLLOKOSA-N	-2	1	385.464	2.691	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)c1	ZINC000739782089	602655711	/nfs/dbraw/zinc/65/57/11/602655711.db2.gz	GFMHJXDSTRXTRT-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])c(OC)c2)c1C	ZINC000739788730	602673497	/nfs/dbraw/zinc/67/34/97/602673497.db2.gz	NDJLMTYLNDKTRF-UHFFFAOYSA-N	-2	1	394.405	2.681	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)c([O-])c1	ZINC000740700231	602842331	/nfs/dbraw/zinc/84/23/31/602842331.db2.gz	TYKSKFCZHIFBSL-QPJJXVBHSA-N	-2	1	381.432	2.953	20	0		GFADML
COc1ccccc1N1CC[C@H](CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000739977639	602856838	/nfs/dbraw/zinc/85/68/38/602856838.db2.gz	PYTFKVRAMWQUNK-CYBMUJFWSA-N	-2	1	385.420	2.747	20	0		GFADML
CN(C[C@H]1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1)C(=O)OC(C)(C)C	ZINC000739658142	602860909	/nfs/dbraw/zinc/86/09/09/602860909.db2.gz	XABPGPJSLZFLHX-GFCCVEGCSA-N	-2	1	393.440	2.811	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCCCC(=O)N2CCc3ccccc32)c([O-])c1	ZINC000740698665	602863454	/nfs/dbraw/zinc/86/34/54/602863454.db2.gz	MWUWXLXWJOQLFO-UHFFFAOYSA-N	-2	1	383.404	2.581	20	0		GFADML
CN(C(=O)c1ccc(NC(=O)[O-])cc1[O-])[C@H]1CCCN(c2ccccc2)C1=O	ZINC000739593586	602865545	/nfs/dbraw/zinc/86/55/45/602865545.db2.gz	IXLXXYBTVLJJLV-INIZCTEOSA-N	-2	1	383.404	2.750	20	0		GFADML
CC(C)[C@@H](NC(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000736376942	603233295	/nfs/dbraw/zinc/23/32/95/603233295.db2.gz	QHDUKCYTYNRWHN-MRXNPFEDSA-N	-2	1	391.449	2.718	20	0		GFADML
C[C@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCCO3)cc1	ZINC000825448936	603402085	/nfs/dbraw/zinc/40/20/85/603402085.db2.gz	HZLXUHGFIWUFMN-NSHDSACASA-N	-2	1	378.406	2.587	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC[C@H]([C@@H]2CCCN2C(=O)[O-])C1	ZINC000830705159	603481256	/nfs/dbraw/zinc/48/12/56/603481256.db2.gz	XMORWJHJKUEFJB-KBPBESRZSA-N	-2	1	390.484	2.783	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)ccc1C	ZINC000828761226	603528133	/nfs/dbraw/zinc/52/81/33/603528133.db2.gz	QNWGNFYLJYMKHK-GFCCVEGCSA-N	-2	1	392.433	2.911	20	0		GFADML
CN(C(=O)[O-])[C@H]1CCN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1	ZINC000827872035	603608405	/nfs/dbraw/zinc/60/84/05/603608405.db2.gz	WHTKHAZPUIKVDO-LBPRGKRZSA-N	-2	1	379.413	2.564	20	0		GFADML
Cc1cc(C)c(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])cc1C(=O)[O-]	ZINC000829998858	604014161	/nfs/dbraw/zinc/01/41/61/604014161.db2.gz	XYUFNWCITPWYQT-UHFFFAOYSA-N	-3	1	390.417	2.843	20	0		GFADML
COc1ccccc1[C@H](C[N-]S(=O)(=O)c1cc2ccccc2o1)NC(=O)[O-]	ZINC000829597435	604019823	/nfs/dbraw/zinc/01/98/23/604019823.db2.gz	HLXPXYGZRZOHBQ-AWEZNQCLSA-N	-2	1	390.417	2.729	20	0		GFADML
C[C@H](CN(C)C(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000824873323	604074535	/nfs/dbraw/zinc/07/45/35/604074535.db2.gz	FHIAGXNCZIDBPF-CYBMUJFWSA-N	-2	1	391.449	2.672	20	0		GFADML
C[C@@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000825449659	604200371	/nfs/dbraw/zinc/20/03/71/604200371.db2.gz	WBUZDGWHUYKBNZ-SECBINFHSA-N	-3	1	382.369	2.653	20	0		GFADML
CCC[C@@H](C)[C@H]1CCCN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000829208097	604342353	/nfs/dbraw/zinc/34/23/53/604342353.db2.gz	IKQJLFKTFMZTJO-RDTXWAMCSA-N	-2	1	385.464	2.834	20	0		GFADML
CCOc1cc(C(=O)Nc2ccc(C(=O)NCC(=O)[O-])cc2)cc(Cl)c1[O-]	ZINC000830039010	604411476	/nfs/dbraw/zinc/41/14/76/604411476.db2.gz	WDLDDWZQFVDPOB-UHFFFAOYSA-N	-2	1	392.795	2.511	20	0		GFADML
Cc1ccc(F)c([N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)c1C(=O)[O-]	ZINC000833749615	604944084	/nfs/dbraw/zinc/94/40/84/604944084.db2.gz	PIKATWYTAYATAU-UHFFFAOYSA-N	-3	1	389.307	2.610	20	0		GFADML
CCC(=O)c1cccc(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000828580746	604958581	/nfs/dbraw/zinc/95/85/81/604958581.db2.gz	SOQXVMKEIPBRGQ-UHFFFAOYSA-N	-2	1	393.399	2.638	20	0		GFADML
CC(C)C[C@H](C)Oc1cc(C[N-]S(=O)(=O)c2csnc2C(=O)[O-])ccn1	ZINC000833475252	605026965	/nfs/dbraw/zinc/02/69/65/605026965.db2.gz	PKPMKDJOHWWZJU-NSHDSACASA-N	-2	1	399.494	2.528	20	0		GFADML
Cc1cc(CN2CCSCC2)ccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])o1	ZINC000833745381	605053556	/nfs/dbraw/zinc/05/35/56/605053556.db2.gz	FTDWPHNDLBDVSJ-UHFFFAOYSA-N	-2	1	396.490	2.636	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccc(NC(=O)[O-])c(F)c1	ZINC000833665850	605319097	/nfs/dbraw/zinc/31/90/97/605319097.db2.gz	OYEQOVPIUXKMMW-UHFFFAOYSA-N	-2	1	381.385	2.930	20	0		GFADML
Cc1cc(Br)c([O-])c(NC(=O)c2csc(CNC(=O)[O-])n2)c1	ZINC000833897951	605472606	/nfs/dbraw/zinc/47/26/06/605472606.db2.gz	PMGRNLSMUUKYAJ-UHFFFAOYSA-N	-2	1	386.227	2.940	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2C[C@H](O)C[C@H]2c2cc(F)ccc2F)c([O-])c1	ZINC000834255854	605665918	/nfs/dbraw/zinc/66/59/18/605665918.db2.gz	IHFZXZAQJOHRRJ-ABAIWWIYSA-N	-2	1	378.331	2.708	20	0		GFADML
C[C@@H]1CN(C(=O)OC(C)(C)C)[C@@H](C)CN1C(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000833836323	605837303	/nfs/dbraw/zinc/83/73/03/605837303.db2.gz	NDAAHHRLXIWCNP-NEPJUHHUSA-N	-2	1	393.440	2.952	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)c(C(=O)[O-])cc1OC	ZINC000013263147	654503700	/nfs/dbraw/zinc/50/37/00/654503700.db2.gz	JGKOCJUDNNDIPB-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(OCC(F)(F)F)nc2)cc1	ZINC000042792426	654644810	/nfs/dbraw/zinc/64/48/10/654644810.db2.gz	BLXIKPIRMHNZGT-UHFFFAOYSA-N	-2	1	376.312	2.522	20	0		GFADML
Cc1cc(Cl)ccc1S(=O)(=O)[N-]NC(=O)c1ccc(Cl)cc1[O-]	ZINC000055664838	654779918	/nfs/dbraw/zinc/77/99/18/654779918.db2.gz	UKPRRIFVYLILTD-UHFFFAOYSA-N	-2	1	375.233	2.631	20	0		GFADML
CN(C)C(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)cc1Cl	ZINC000057125313	654801371	/nfs/dbraw/zinc/80/13/71/654801371.db2.gz	WUXHXCVXMHQOIR-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
C[C@@H](CCC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br	ZINC000274952451	655208643	/nfs/dbraw/zinc/20/86/43/655208643.db2.gz	GLRPVPAJPXJGOM-LURJTMIESA-N	-2	1	388.642	2.773	20	0		GFADML
O=C([O-])c1ccc(F)c(S(=O)(=O)[N-]c2cc3c(cc2Cl)OCCO3)c1	ZINC000326676386	655385231	/nfs/dbraw/zinc/38/52/31/655385231.db2.gz	OHTALPHKNFYYJM-UHFFFAOYSA-N	-2	1	387.772	2.749	20	0		GFADML
COC(=O)Nc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)ccc1F	ZINC000729665836	655566494	/nfs/dbraw/zinc/56/64/94/655566494.db2.gz	NRINVTKMBWKINI-UHFFFAOYSA-N	-2	1	388.398	2.873	20	0		GFADML
CN(C)C(=O)Sc1cccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])c1	ZINC000737353009	655671415	/nfs/dbraw/zinc/67/14/15/655671415.db2.gz	UQEZXAAGFKJFDM-UHFFFAOYSA-N	-2	1	380.447	2.959	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])cc(C(=O)[O-])c1F	ZINC000758148998	655924127	/nfs/dbraw/zinc/92/41/27/655924127.db2.gz	QVBWWKCKWLJWQF-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(C)c(Cl)c(C(=O)[O-])c2)cc1	ZINC000759091266	655946958	/nfs/dbraw/zinc/94/69/58/655946958.db2.gz	MEZUXZDWVXKIFL-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1ccc([C@H]([N-]S(=O)(=O)c2c(Cl)ccnc2Cl)C(=O)[O-])cc1	ZINC000776500139	656747996	/nfs/dbraw/zinc/74/79/96/656747996.db2.gz	LTEPVUSLWBQZMX-NSHDSACASA-N	-2	1	375.233	2.801	20	0		GFADML
CCC[C@H](C(=O)OCC)S(=O)(=O)[N-]c1ccc(S[C@H](C)C(=O)[O-])cc1	ZINC000844662114	661432941	/nfs/dbraw/zinc/43/29/41/661432941.db2.gz	MBABBNPDVZYSNE-BXUZGUMPSA-N	-2	1	389.495	2.725	20	0		GFADML
O=C([O-])C1=CC[C@H]([N-]S(=O)(=O)c2c(Cl)cc(F)cc2Br)C1	ZINC000853069094	661880441	/nfs/dbraw/zinc/88/04/41/661880441.db2.gz	LOTSNURGDMPAHL-QMMMGPOBSA-N	-2	1	398.637	2.693	20	0		GFADML
C[C@@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])oc1Br)CC(F)(F)F	ZINC000396906074	677411561	/nfs/dbraw/zinc/41/15/61/677411561.db2.gz	FCDLPYKKUOWTLU-RXMQYKEDSA-N	-2	1	394.165	2.607	20	0		GFADML
COc1cc(C(=O)[O-])cc(NS(=O)(=O)c2cccc(Cl)c2[O-])c1OC	ZINC000436476644	450598921	/nfs/dbraw/zinc/59/89/21/450598921.db2.gz	JUFRFRKQLBUCOU-UHFFFAOYSA-N	-2	1	387.797	2.562	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)NC(=O)CS2	ZINC000013032321	551108642	/nfs/dbraw/zinc/10/86/42/551108642.db2.gz	MBJDKOCSWLIFAK-UHFFFAOYSA-N	-2	1	378.431	2.538	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(-c3nc[nH]n3)c2)ccc1Cl	ZINC000371714227	563285404	/nfs/dbraw/zinc/28/54/04/563285404.db2.gz	ITZJWSRHMKTWNO-UHFFFAOYSA-N	-2	1	378.797	2.624	20	0		GFADML
O=C([O-])[C@H](Cc1ccc(O)cc1)[N-]S(=O)(=O)c1cc(Cl)sc1Cl	ZINC000320037280	563446431	/nfs/dbraw/zinc/44/64/31/563446431.db2.gz	PUEVKAILXZTMTL-VIFPVBQESA-N	-2	1	396.273	2.735	20	0		GFADML
O=C(c1ccc(Br)cc1[O-])N1CCC(c2n[n-]c(=S)o2)CC1	ZINC000377180073	563466056	/nfs/dbraw/zinc/46/60/56/563466056.db2.gz	XQMDMFADBHGASC-UHFFFAOYSA-N	-2	1	384.255	2.846	20	0		GFADML
C[C@@H]1C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(Cl)c(C(=O)[O-])c3)cc21	ZINC000392296567	563526450	/nfs/dbraw/zinc/52/64/50/563526450.db2.gz	UALYLVVBMMUKGI-QMMMGPOBSA-N	-2	1	380.809	2.895	20	0		GFADML
C[C@@H]1CSC[C@@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436623240	563675409	/nfs/dbraw/zinc/67/54/09/563675409.db2.gz	GCCXGGXFIXZOPV-MFKMUULPSA-N	-2	1	398.531	2.736	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2cccc(CC(=O)[O-])c2)cc1Cl	ZINC000566770008	564342276	/nfs/dbraw/zinc/34/22/76/564342276.db2.gz	IFROXTUXCJREKK-UHFFFAOYSA-N	-2	1	382.825	2.726	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cccc(F)c1F)Cc1ccc(Cl)cc1	ZINC000548203368	564535739	/nfs/dbraw/zinc/53/57/39/564535739.db2.gz	KKBDPPWUUUDOIW-LLVKDONJSA-N	-2	1	389.807	2.840	20	0		GFADML
C[C@H](CCC(=O)[O-])C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000548219946	564538496	/nfs/dbraw/zinc/53/84/96/564538496.db2.gz	VJTDBUCEXPWCCO-SSDOTTSWSA-N	-2	1	386.214	2.507	20	0		GFADML
CC(C)=CCSC[C@H]([N-]S(=O)(=O)c1cc(F)c(F)cc1F)C(=O)[O-]	ZINC000548591716	564564727	/nfs/dbraw/zinc/56/47/27/564564727.db2.gz	MFAGTTNWSXPSBB-LBPRGKRZSA-N	-2	1	383.413	2.535	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)[C@@H](C)C(=O)[O-]	ZINC000571997151	564576403	/nfs/dbraw/zinc/57/64/03/564576403.db2.gz	UDFGQLLRMMIWCX-PHDIDXHHSA-N	-2	1	388.642	2.629	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C(=O)[O-])c2)c(Cl)c1	ZINC000572404151	564593553	/nfs/dbraw/zinc/59/35/53/564593553.db2.gz	XEMUMALVLGRCOB-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
O=C([O-])[C@H](CC1CC1)[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000552001372	564672478	/nfs/dbraw/zinc/67/24/78/564672478.db2.gz	ZBGUCIKUUKZWJO-LURJTMIESA-N	-2	1	388.692	2.696	20	0		GFADML
CC(C)(C[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)C(=O)[O-]	ZINC000527067178	564729174	/nfs/dbraw/zinc/72/91/74/564729174.db2.gz	FYOHHRKWYUEEEE-UHFFFAOYSA-N	-2	1	388.642	2.631	20	0		GFADML
O=C(Nc1cccc(-c2nc(=O)o[n-]2)c1)c1cc(Br)ccc1[O-]	ZINC000591830438	565241554	/nfs/dbraw/zinc/24/15/54/565241554.db2.gz	OFKNEHWFRXXTRA-UHFFFAOYSA-N	-2	1	376.166	2.750	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC[C@@H]2C[C@@H]2C1	ZINC000619346272	565337380	/nfs/dbraw/zinc/33/73/80/565337380.db2.gz	HAZBJABZUAQHQE-VXGBXAGGSA-N	-2	1	378.475	2.737	20	0		GFADML
CO[C@@H](C[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-])C1CC1	ZINC000656168143	566108434	/nfs/dbraw/zinc/10/84/34/566108434.db2.gz	DEQSKZMTYAZVJH-YUMQZZPRSA-N	-2	1	388.294	2.602	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)N(C)CCC(=O)[O-])c1	ZINC000262507912	597010356	/nfs/dbraw/zinc/01/03/56/597010356.db2.gz	JNJJLFAWOKXXHU-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
Cn1ccnc1-c1cccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])c1	ZINC000739043949	599885818	/nfs/dbraw/zinc/88/58/18/599885818.db2.gz	UHRJNHOZDOUWFL-UHFFFAOYSA-N	-2	1	375.381	2.725	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(C(=O)NCC(C)C)cc1	ZINC000477395262	599905751	/nfs/dbraw/zinc/90/57/51/599905751.db2.gz	DNYJQDDKCOYVDU-UHFFFAOYSA-N	-2	1	390.461	2.880	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(-c2nnc3n2CCC3)cc1	ZINC000738277116	599906212	/nfs/dbraw/zinc/90/62/12/599906212.db2.gz	FWMCCLPWEQDWSC-UHFFFAOYSA-N	-2	1	398.444	2.699	20	0		GFADML
CCOc1cc(C(=O)Nc2ccc(-c3cc(=O)[nH][n-]3)cc2)ccc1OCC(=O)[O-]	ZINC000737185588	599989060	/nfs/dbraw/zinc/98/90/60/599989060.db2.gz	WLWFJNINNYXFMS-UHFFFAOYSA-N	-2	1	397.387	2.897	20	0		GFADML
CCCN(CC(=O)[O-])C(=O)c1cccc(S(=O)(=O)[N-]c2cccc(C)c2)c1	ZINC000262417209	600022967	/nfs/dbraw/zinc/02/29/67/600022967.db2.gz	ZLCZBQFTPYYVEQ-UHFFFAOYSA-N	-2	1	390.461	2.733	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(OC[C@@H]2CCCO2)cc1	ZINC000740143106	600096570	/nfs/dbraw/zinc/09/65/70/600096570.db2.gz	CEIQHZCWGBTLKP-HNNXBMFYSA-N	-2	1	395.408	2.883	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1NC(=O)CSc1nc(C(F)(F)F)cc(=O)[n-]1	ZINC000738527716	600120545	/nfs/dbraw/zinc/12/05/45/600120545.db2.gz	ANIAIAAUCYUEFT-UHFFFAOYSA-N	-2	1	387.339	2.938	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)c(F)c1	ZINC000737699131	600170139	/nfs/dbraw/zinc/17/01/39/600170139.db2.gz	HRDFBFOCVZSJPC-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)N(C)C(C)(C)C(=O)[O-])cc1	ZINC000262488397	600171878	/nfs/dbraw/zinc/17/18/78/600171878.db2.gz	VZSCEDILRFCPCY-UHFFFAOYSA-N	-2	1	390.461	2.731	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)c(F)cc1F	ZINC000740090090	600234331	/nfs/dbraw/zinc/23/43/31/600234331.db2.gz	RULGCBPCGZOTHL-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(OCC(F)(F)F)cc2)c(C(=O)[O-])[nH]1	ZINC000738463408	600255599	/nfs/dbraw/zinc/25/55/99/600255599.db2.gz	AIPARDAOXWAGAK-UHFFFAOYSA-N	-2	1	378.328	2.763	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1Cl	ZINC000057178025	600481844	/nfs/dbraw/zinc/48/18/44/600481844.db2.gz	YEPQFGTZAYRMIJ-UHFFFAOYSA-N	-2	1	379.777	2.945	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)ccc1OC	ZINC000737682296	600546051	/nfs/dbraw/zinc/54/60/51/600546051.db2.gz	ZKBIRCKNWUGXIJ-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@@H](C(=O)[O-])c1ccccc1F	ZINC000830136676	600653244	/nfs/dbraw/zinc/65/32/44/600653244.db2.gz	DYBMQOSFEAFZTF-OAHLLOKOSA-N	-2	1	381.381	2.570	20	0		GFADML
CN(Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1)C(=O)[O-]	ZINC000830840492	600684418	/nfs/dbraw/zinc/68/44/18/600684418.db2.gz	OHYUBYPGJPMFCW-UHFFFAOYSA-N	-3	1	398.824	2.949	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cccc3ncccc32)ccc1C(=O)[O-]	ZINC000831327738	600689397	/nfs/dbraw/zinc/68/93/97/600689397.db2.gz	NILDGKSAHZOARM-UHFFFAOYSA-N	-2	1	386.385	2.520	20	0		GFADML
Cc1cc(C(=O)Nc2ccc(C(C)C)cc2C(=O)[O-])[nH]c2nc(=O)[n-]c(=O)c1-2	ZINC000738336123	600758454	/nfs/dbraw/zinc/75/84/54/600758454.db2.gz	YTYSKJIIMOZXDI-UHFFFAOYSA-N	-2	1	382.376	2.818	20	0		GFADML
CCC[C@@]1(C)CCCN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000829238589	600968433	/nfs/dbraw/zinc/96/84/33/600968433.db2.gz	XLLYMULDVRHDPQ-NRFANRHFSA-N	-2	1	385.464	2.835	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(Br)c(F)c2)ccc1O	ZINC000316748369	601049185	/nfs/dbraw/zinc/04/91/85/601049185.db2.gz	LVZJUZYXBWMLBU-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
COCc1nc2cc([N-]S(=O)(=O)c3cccc(C(=O)[O-])c3C)ccc2o1	ZINC000831831396	601230036	/nfs/dbraw/zinc/23/00/36/601230036.db2.gz	JQPAOTSYBUTMEU-UHFFFAOYSA-N	-2	1	376.390	2.782	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)ccc1NC(C)=O	ZINC000832025864	601323141	/nfs/dbraw/zinc/32/31/41/601323141.db2.gz	FUHYWFCZSMFURW-BJMVGYQFSA-N	-2	1	390.417	2.552	20	0		GFADML
COC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1	ZINC000831209581	601324995	/nfs/dbraw/zinc/32/49/95/601324995.db2.gz	BZRQJPVGDHWVEL-UHFFFAOYSA-N	-2	1	378.406	2.981	20	0		GFADML
CCOc1cc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)ccc1OC	ZINC000830049651	601325166	/nfs/dbraw/zinc/32/51/66/601325166.db2.gz	LOCWSLTXRJQBQH-WDZFZDKYSA-N	-2	1	377.418	2.993	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc3c(C(=O)[O-])c[nH]c3c2)c1C	ZINC000521961992	601330766	/nfs/dbraw/zinc/33/07/66/601330766.db2.gz	FUNVRHGNCOSXKC-UHFFFAOYSA-N	-3	1	388.401	2.982	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000609985986	601332234	/nfs/dbraw/zinc/33/22/34/601332234.db2.gz	XNAYHWFTQALZJT-UHFFFAOYSA-N	-2	1	391.445	2.908	20	0		GFADML
CCN(CC)C(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)cc1	ZINC000013265522	601357388	/nfs/dbraw/zinc/35/73/88/601357388.db2.gz	ORJPNRMISXXVBG-UHFFFAOYSA-N	-2	1	376.434	2.668	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cs1)c1nc(C2CCCCC2)no1	ZINC000827747963	601384947	/nfs/dbraw/zinc/38/49/47/601384947.db2.gz	XHFFHYPPLKVFFU-VIFPVBQESA-N	-2	1	385.467	2.917	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@@H](c2ccccc2)[C@@H](C)C(=O)[O-])c(=O)[n-]1	ZINC000832794188	601392207	/nfs/dbraw/zinc/39/22/07/601392207.db2.gz	DXBQZRANMSFZEX-BDJLRTHQSA-N	-2	1	389.477	2.723	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)[O-])c1C	ZINC000477420663	601575709	/nfs/dbraw/zinc/57/57/09/601575709.db2.gz	GFKPFBOTZBBAHY-UHFFFAOYSA-N	-2	1	393.417	2.981	20	0		GFADML
C[C@@H](CS(=O)(=O)Nc1cc(C(=O)[O-])ccc1Oc1ccccc1)C(=O)[O-]	ZINC000827571482	601615667	/nfs/dbraw/zinc/61/56/67/601615667.db2.gz	KLRPGLJKMHZNMT-NSHDSACASA-N	-2	1	379.390	2.640	20	0		GFADML
Cc1cc(C(=O)OCc2cc(=O)oc3cc([O-])ccc23)cc(C)c1OCC(=O)[O-]	ZINC000832869827	601681237	/nfs/dbraw/zinc/68/12/37/601681237.db2.gz	PRWCQWNEHSDPTE-UHFFFAOYSA-N	-2	1	398.367	2.936	20	0		GFADML
CC[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)cc1)C(=O)[O-]	ZINC000572232310	601749305	/nfs/dbraw/zinc/74/93/05/601749305.db2.gz	FTTPYXFETKCRNM-MRXNPFEDSA-N	-2	1	390.461	2.697	20	0		GFADML
CC[C@@H](NC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2)c1)C(=O)[O-]	ZINC000485872017	601752699	/nfs/dbraw/zinc/75/26/99/601752699.db2.gz	CWUGBPSBSWLCIG-OAHLLOKOSA-N	-2	1	396.852	2.734	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)ccc1C	ZINC000747621383	601830213	/nfs/dbraw/zinc/83/02/13/601830213.db2.gz	SZQOJTLNUQQBJO-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)NCc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000735269025	601830247	/nfs/dbraw/zinc/83/02/47/601830247.db2.gz	CQMFJJTYQQAWEN-UHFFFAOYSA-N	-2	1	398.824	2.695	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2C)cc(F)c1F	ZINC000755959380	601831231	/nfs/dbraw/zinc/83/12/31/601831231.db2.gz	SJGFEJGWWNWECE-UHFFFAOYSA-N	-2	1	385.344	2.559	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-c3ncon3)cc2)cc(F)c1F	ZINC000751141425	601839710	/nfs/dbraw/zinc/83/97/10/601839710.db2.gz	BIKSNQDZKMLMTM-UHFFFAOYSA-N	-2	1	381.316	2.514	20	0		GFADML
Cn1ccnc1-c1cccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])c1	ZINC000833059755	601848066	/nfs/dbraw/zinc/84/80/66/601848066.db2.gz	ZVFQVUAZMFQHFK-UHFFFAOYSA-N	-2	1	375.381	2.725	20	0		GFADML
CCC[C@H](C)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)OC)c2)[nH]n1	ZINC000829216253	601861769	/nfs/dbraw/zinc/86/17/69/601861769.db2.gz	LQOBJLPOLFGYPK-JTQLQIEISA-N	-2	1	395.437	2.599	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1c(C)ccc(Cl)c1C(=O)[O-]	ZINC000475737656	601881308	/nfs/dbraw/zinc/88/13/08/601881308.db2.gz	FSJLITOZCQWHSU-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C(=O)OCCCNC(=O)[O-])cc2)cc1	ZINC000740139502	602227175	/nfs/dbraw/zinc/22/71/75/602227175.db2.gz	OLNFBRWEKXEIBE-UHFFFAOYSA-N	-2	1	392.433	2.610	20	0		GFADML
CC(=O)N1CCCc2cc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])cc3)ccc21	ZINC000738523530	602645976	/nfs/dbraw/zinc/64/59/76/602645976.db2.gz	KSAVANNOKJMHIF-UHFFFAOYSA-N	-2	1	389.433	2.876	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2ccc(OCC(F)(F)F)nc2)c([O-])c1	ZINC000740697168	602849546	/nfs/dbraw/zinc/84/95/46/602849546.db2.gz	CGXCIHUMLYWEPA-UHFFFAOYSA-N	-2	1	385.298	2.748	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCC[C@@H](NC(=O)[O-])C2)c([O-])c1	ZINC000737583557	602852300	/nfs/dbraw/zinc/85/23/00/602852300.db2.gz	FTVLSVFXNJSGIR-GFCCVEGCSA-N	-2	1	379.413	2.611	20	0		GFADML
CCCCCC(=O)NC1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000739330438	602856928	/nfs/dbraw/zinc/85/69/28/602856928.db2.gz	NIJLUYFVEIPDMZ-UHFFFAOYSA-N	-2	1	377.441	2.783	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C[C@H](C)N1C(=O)[O-]	ZINC000739172736	602864487	/nfs/dbraw/zinc/86/44/87/602864487.db2.gz	XGRGHNFKEARFNQ-TXEJJXNPSA-N	-2	1	393.440	2.952	20	0		GFADML
O=C([O-])N1CCC([N-]S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)CC1	ZINC000738638240	603083935	/nfs/dbraw/zinc/08/39/35/603083935.db2.gz	GECYUPMFIGOOSE-UHFFFAOYSA-N	-2	1	386.779	2.780	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN(C(=O)[O-])C3)cc1C	ZINC000739933374	603182626	/nfs/dbraw/zinc/18/26/26/603182626.db2.gz	PVLIFGJWIXJNMU-UHFFFAOYSA-N	-2	1	376.434	2.841	20	0		GFADML
C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3cc4c(cc3NC(=O)[O-])OCO4)ccc2O1	ZINC000826094104	603887644	/nfs/dbraw/zinc/88/76/44/603887644.db2.gz	RXTZVUQZFVUDQM-SECBINFHSA-N	-2	1	392.389	2.629	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)c([O-])c1	ZINC000832833712	604009793	/nfs/dbraw/zinc/00/97/93/604009793.db2.gz	RANKUHKJWAJNBC-NSHDSACASA-N	-2	1	376.800	2.539	20	0		GFADML
CSc1nc(C)c(CCC(=O)O[C@H](C)[C@H]2CCCCN2C(=O)[O-])c(=O)[n-]1	ZINC000829777715	604120178	/nfs/dbraw/zinc/12/01/78/604120178.db2.gz	LEMKXNHXFGBYSW-DGCLKSJQSA-N	-2	1	383.470	2.609	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(F)c2)cc1	ZINC000489763499	604769152	/nfs/dbraw/zinc/76/91/52/604769152.db2.gz	ILJAPWQLWUMNPK-UHFFFAOYSA-N	-3	1	381.381	2.687	20	0		GFADML
Cc1oc(S(=O)(=O)[N-]c2cc(CN3CCCC3)ccc2C)cc1C(=O)[O-]	ZINC000832932725	604772834	/nfs/dbraw/zinc/77/28/34/604772834.db2.gz	VTOOVLOELPEPFI-UHFFFAOYSA-N	-2	1	378.450	2.991	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000438814196	604990702	/nfs/dbraw/zinc/99/07/02/604990702.db2.gz	VXKIYDQTJWJAOX-UHFFFAOYSA-N	-2	1	396.852	2.897	20	0		GFADML
CCC[C@H](NC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-])C(=O)[O-]	ZINC000833649439	605023312	/nfs/dbraw/zinc/02/33/12/605023312.db2.gz	QTBPSOYQLQFZPC-HNNXBMFYSA-N	-2	1	392.358	2.906	20	0		GFADML
Cc1cc(CN2CCSCC2)ccc1[N-]S(=O)(=O)c1cc(C(=O)[O-])co1	ZINC000833745411	605053995	/nfs/dbraw/zinc/05/39/95/605053995.db2.gz	GVSFLYIRRBAYAT-UHFFFAOYSA-N	-2	1	396.490	2.636	20	0		GFADML
Cn1ccnc1[C@@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1ccccc1F	ZINC000833954386	605627633	/nfs/dbraw/zinc/62/76/33/605627633.db2.gz	IGMGEWHONAQRFY-INIZCTEOSA-N	-2	1	384.367	2.874	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)c([O-])c1	ZINC000834255864	605666212	/nfs/dbraw/zinc/66/62/12/605666212.db2.gz	IHFZXZAQJOHRRJ-XHDPSFHLSA-N	-2	1	378.331	2.708	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(NC(=O)[O-])ccc2C)cc1C	ZINC000833880798	605991847	/nfs/dbraw/zinc/99/18/47/605991847.db2.gz	NKSBXNMJEMDJPG-UHFFFAOYSA-N	-2	1	378.406	2.981	20	0		GFADML
O=S(=O)([N-]c1ncc(-c2nn[n-]n2)s1)c1ccc(-c2ccccc2)cc1	ZINC000823589073	607027112	/nfs/dbraw/zinc/02/71/12/607027112.db2.gz	LQXCHOHVYSHTHH-UHFFFAOYSA-N	-2	1	384.446	2.791	20	0		GFADML
Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(Cl)c(C(N)=O)c2)cc1C(=O)[O-]	ZINC000042794034	654644773	/nfs/dbraw/zinc/64/47/73/654644773.db2.gz	IOVGQZSQSDCTQN-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1cc(Br)c(S(=O)(=O)[N-][C@@H](CC(F)(F)F)C(=O)[O-])s1	ZINC000275382626	655233038	/nfs/dbraw/zinc/23/30/38/655233038.db2.gz	ZTQZXXHOTNYHSC-LURJTMIESA-N	-2	1	396.206	2.503	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1C(=O)[O-]	ZINC000327634604	655386368	/nfs/dbraw/zinc/38/63/68/655386368.db2.gz	QQLYHJCAEMWTGG-UHFFFAOYSA-N	-2	1	386.769	2.756	20	0		GFADML
O=C([O-])[C@H](C[C@@H]1CCOC1)[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000577356161	655457527	/nfs/dbraw/zinc/45/75/27/655457527.db2.gz	BTVGEYUPKNCPOK-ONGXEEELSA-N	-2	1	389.882	2.713	20	0		GFADML
COC[C@H]([N-]S(=O)(=O)c1cc(Cl)c(F)c(C(=O)[O-])c1)c1ccc(C)o1	ZINC000761308218	656009939	/nfs/dbraw/zinc/00/99/39/656009939.db2.gz	FADGVNXOEBUEKP-LBPRGKRZSA-N	-2	1	391.804	2.745	20	0		GFADML
COCCC1(C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CCCC1	ZINC000761314911	656010701	/nfs/dbraw/zinc/01/07/01/656010701.db2.gz	XWCNBOFBDMLTRB-UHFFFAOYSA-N	-2	1	377.409	2.538	20	0		GFADML
Cc1cc(F)c(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cl)c1C(=O)[O-]	ZINC000793394910	658393086	/nfs/dbraw/zinc/39/30/86/658393086.db2.gz	PRXBDWPZHWBHLB-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])c1cc(Br)c(S(=O)(=O)[N-][C@@H]2CCC(F)(F)C2)s1	ZINC000871921847	662742100	/nfs/dbraw/zinc/74/21/00/662742100.db2.gz	SPPDCKSKZVAKJF-RXMQYKEDSA-N	-2	1	390.227	2.675	20	0		GFADML
CC(C)(C)[C@@H]1C[C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CCO1	ZINC000871929664	662743115	/nfs/dbraw/zinc/74/31/15/662743115.db2.gz	FMBHGCPVNRZTFG-MFKMUULPSA-N	-2	1	377.409	2.535	20	0		GFADML
Cc1cc(Cl)ccc1CN1CCC[C@@H]([N-]C(=O)C(F)(F)F)[C@H]1C(=O)[O-]	ZINC000903707176	663804535	/nfs/dbraw/zinc/80/45/35/663804535.db2.gz	SHZWTZVDDLGGJX-OLZOCXBDSA-N	-2	1	378.778	2.745	20	0		GFADML
CNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1C	ZINC000327710186	563459363	/nfs/dbraw/zinc/45/93/63/563459363.db2.gz	ZVSLFGFRYHRWJG-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)[N-]c1cc(F)cc(F)c1F	ZINC000431158245	563555334	/nfs/dbraw/zinc/55/53/34/563555334.db2.gz	IAORSCAKQWHQKI-UHFFFAOYSA-N	-2	1	375.324	2.540	20	0		GFADML
C[C@H]1C[C@@H](NC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])CS1	ZINC000412569295	563661797	/nfs/dbraw/zinc/66/17/97/563661797.db2.gz	HRHVMCARIKEVCU-CMPLNLGQSA-N	-2	1	398.531	2.878	20	0		GFADML
CC(C)[C@@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000564841063	564251280	/nfs/dbraw/zinc/25/12/80/564251280.db2.gz	YFNSJIKYPLTDLN-ZCFIWIBFSA-N	-2	1	390.708	2.942	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2ccc3scnc3c2)cc1F	ZINC000509565537	564304078	/nfs/dbraw/zinc/30/40/78/564304078.db2.gz	AATPCZWWCXYLHN-UHFFFAOYSA-N	-2	1	382.394	2.700	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2C)cc1	ZINC000476276528	564333368	/nfs/dbraw/zinc/33/33/68/564333368.db2.gz	NUVABWRUSVGBJT-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)c(C)c(C(=O)[O-])c2)cc1	ZINC000479251032	564433613	/nfs/dbraw/zinc/43/36/13/564433613.db2.gz	RURCEAAVBOPKQY-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc2c(c1)CC(=O)N2	ZINC000479427015	564439740	/nfs/dbraw/zinc/43/97/40/564439740.db2.gz	RQAVELKAXJKBQW-UHFFFAOYSA-N	-2	1	380.809	2.642	20	0		GFADML
Cc1cc(C)c(S(=O)(=O)[N-]c2ccccc2C[S@@](C)=O)cc1C(=O)[O-]	ZINC000547240541	564480232	/nfs/dbraw/zinc/48/02/32/564480232.db2.gz	YZQUGVQPOXJPRW-XMMPIXPASA-N	-2	1	381.475	2.681	20	0		GFADML
O=C([O-])[C@@H]1CCCCCC[C@H]1[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000547934786	564523282	/nfs/dbraw/zinc/52/32/82/564523282.db2.gz	JBYUSZPGNXIPDL-NXEZZACHSA-N	-2	1	380.260	2.744	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)ccc1Cl	ZINC000481983911	564530979	/nfs/dbraw/zinc/53/09/79/564530979.db2.gz	SWNWTLUUTXTFIF-UHFFFAOYSA-N	-2	1	382.825	2.726	20	0		GFADML
O=C([O-])C1(C[N-]S(=O)(=O)c2cc(Br)c(F)cc2F)CCCC1	ZINC000548221530	564538529	/nfs/dbraw/zinc/53/85/29/564538529.db2.gz	XGSGRKPJVSUAMH-UHFFFAOYSA-N	-2	1	398.225	2.651	20	0		GFADML
Cc1ccc(Cl)c(S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(F)F)c1Cl	ZINC000572984257	564618313	/nfs/dbraw/zinc/61/83/13/564618313.db2.gz	WSXYRIRAKDJCIB-ZETCQYMHSA-N	-2	1	376.208	2.936	20	0		GFADML
O=C([O-])c1cc(F)c(F)cc1[N-]S(=O)(=O)CCOc1ccc(F)cc1	ZINC000460833428	564781985	/nfs/dbraw/zinc/78/19/85/564781985.db2.gz	TVASCLQVBHORIP-UHFFFAOYSA-N	-2	1	375.324	2.623	20	0		GFADML
Cc1c(Br)cc([N-]S(=O)(=O)c2cccc(N)c2)cc1C(=O)[O-]	ZINC000556414969	564825276	/nfs/dbraw/zinc/82/52/76/564825276.db2.gz	VBQZJWFYXVAMOA-UHFFFAOYSA-N	-2	1	385.239	2.839	20	0		GFADML
O=C(CNC(=O)c1ncccc1[O-])Nc1c([O-])c(Cl)cc(Cl)c1Cl	ZINC000496845762	564861628	/nfs/dbraw/zinc/86/16/28/564861628.db2.gz	KVDRLKSZKDZVHO-UHFFFAOYSA-N	-2	1	390.610	2.822	20	0		GFADML
O=C(NC[C@H]1CCCS1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000531560894	564913544	/nfs/dbraw/zinc/91/35/44/564913544.db2.gz	PRHYZUYYJFAKMR-GFCCVEGCSA-N	-2	1	398.531	2.880	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(Br)cc(C(=O)[O-])c2)cc1	ZINC000536490467	565038614	/nfs/dbraw/zinc/03/86/14/565038614.db2.gz	GGUGEOBCJYCLSF-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
O=C(N[C@@]12C[C@@H]1CCC2)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000617202037	565226761	/nfs/dbraw/zinc/22/67/61/565226761.db2.gz	KQOKLXWGOBXHOT-GTNSWQLSSA-N	-2	1	378.475	2.927	20	0		GFADML
O=C([O-])[C@H](Cc1ccncc1)[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl	ZINC000647928751	565684215	/nfs/dbraw/zinc/68/42/15/565684215.db2.gz	UUFLGSJFIUNBGW-JTQLQIEISA-N	-2	1	393.223	2.502	20	0		GFADML
O=C([O-])CC[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000650420702	565820078	/nfs/dbraw/zinc/82/00/78/565820078.db2.gz	KUXPOGNJABPTOZ-JQWIXIFHSA-N	-2	1	380.388	2.802	20	0		GFADML
O=C([O-])c1cc(Br)cc(S(=O)(=O)[N-]c2c(O)cccc2F)c1	ZINC000677804114	565984474	/nfs/dbraw/zinc/98/44/74/565984474.db2.gz	ARAZREBTGAUTCE-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
CC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000608341639	566010832	/nfs/dbraw/zinc/01/08/32/566010832.db2.gz	FZUAKAOLQCCILC-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
CC[C@@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000654783582	566023060	/nfs/dbraw/zinc/02/30/60/566023060.db2.gz	ZIXJMOUECJAWGS-ZETCQYMHSA-N	-2	1	386.214	2.649	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])cc1	ZINC000609984812	566060154	/nfs/dbraw/zinc/06/01/54/566060154.db2.gz	GSYFONREUPHYEY-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
O=C([O-])CCC[N-]S(=O)(=O)c1cc(Cl)c(Cl)cc1Br	ZINC000656509179	566129023	/nfs/dbraw/zinc/12/90/23/566129023.db2.gz	NRKBLIVNBHXSHH-UHFFFAOYSA-N	-2	1	391.070	2.899	20	0		GFADML
CCOc1ccc(C[C@H](C[N-]S(=O)(=O)c2cccc(F)c2F)C(=O)[O-])cc1	ZINC000737205309	599730177	/nfs/dbraw/zinc/73/01/77/599730177.db2.gz	IMRWATFPWNAZKW-CYBMUJFWSA-N	-2	1	399.415	2.585	20	0		GFADML
Cc1ccc(NC(=O)CCCNC(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1	ZINC000738616030	599746831	/nfs/dbraw/zinc/74/68/31/599746831.db2.gz	NLRQDXKPNAQZNN-UHFFFAOYSA-N	-2	1	391.449	2.782	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000547559714	599873474	/nfs/dbraw/zinc/87/34/74/599873474.db2.gz	OUBYSKKJGDYWKI-UHFFFAOYSA-N	-2	1	394.836	2.966	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)ccc1C(=O)NC(C)C	ZINC000518687053	599908111	/nfs/dbraw/zinc/90/81/11/599908111.db2.gz	MASLIZJXQODZCS-UHFFFAOYSA-N	-2	1	376.434	2.632	20	0		GFADML
O=C([O-])CSCc1cccc([N-]S(=O)(=O)c2ccc3c(c2)COC3)c1	ZINC000739874735	599927084	/nfs/dbraw/zinc/92/70/84/599927084.db2.gz	YGSVLGQHIPGVGY-UHFFFAOYSA-N	-2	1	379.459	2.835	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)nc2)ccc1O	ZINC000740090544	599982374	/nfs/dbraw/zinc/98/23/74/599982374.db2.gz	XEUPSWMLTRDRRF-UHFFFAOYSA-N	-2	1	378.406	2.608	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])cc(C(=O)OC)c2)cc1C	ZINC000737210107	600023021	/nfs/dbraw/zinc/02/30/21/600023021.db2.gz	JSLRWVDFTGTICW-UHFFFAOYSA-N	-2	1	393.417	2.679	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1cccc(N2CCCCC2=O)c1	ZINC000740147169	600096982	/nfs/dbraw/zinc/09/69/82/600096982.db2.gz	ZQSFJNIMXUASDG-UHFFFAOYSA-N	-2	1	392.408	2.842	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)c1C	ZINC000738345598	600301408	/nfs/dbraw/zinc/30/14/08/600301408.db2.gz	NYXLILMNZPUEBH-UHFFFAOYSA-N	-3	1	392.433	2.912	20	0		GFADML
C[S@](=O)Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc(C(=O)[O-])cs2)c1	ZINC000738179040	600302583	/nfs/dbraw/zinc/30/25/83/600302583.db2.gz	GEQRBEOWCCWRTK-QFIPXVFZSA-N	-2	1	393.895	2.779	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])c1	ZINC000737142571	600395803	/nfs/dbraw/zinc/39/58/03/600395803.db2.gz	HGXJDUCVUCKRSO-UHFFFAOYSA-N	-2	1	397.836	2.945	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]CCc2ccc(NC(=O)[O-])cc2)c(F)c1	ZINC000737890398	600446919	/nfs/dbraw/zinc/44/69/19/600446919.db2.gz	YKZNJNYBZMDNSH-UHFFFAOYSA-N	-2	1	386.376	2.584	20	0		GFADML
CC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(OCCCC(=O)[O-])cc2)cc1	ZINC000736192254	600488801	/nfs/dbraw/zinc/48/88/01/600488801.db2.gz	RRBGGBOQBPNVEW-UHFFFAOYSA-N	-2	1	377.418	2.934	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(OCCCC#N)c2)cc1C(=O)[O-]	ZINC000048382690	600542584	/nfs/dbraw/zinc/54/25/84/600542584.db2.gz	FNMQWBLPHWZNDD-UHFFFAOYSA-N	-2	1	390.417	2.877	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1Cl	ZINC000481986201	600628247	/nfs/dbraw/zinc/62/82/47/600628247.db2.gz	ZXYHJSMNHPQFRU-UHFFFAOYSA-N	-2	1	399.852	2.793	20	0		GFADML
CC(=O)N(C)c1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000825823425	600817523	/nfs/dbraw/zinc/81/75/23/600817523.db2.gz	RKOMYYXCDIAMOB-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(N3CCOC3=O)cc2)c1	ZINC000740076237	600891365	/nfs/dbraw/zinc/89/13/65/600891365.db2.gz	TUUJAWOXEWWOQT-UHFFFAOYSA-N	-2	1	396.808	2.796	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(Cn3cnc4ccccc43)cc2)c[nH]1	ZINC000833305902	600979977	/nfs/dbraw/zinc/97/99/77/600979977.db2.gz	UPCFQWMBYVJTLU-UHFFFAOYSA-N	-2	1	396.428	2.912	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(NC(=O)c3ccccc3)nc2)cc1	ZINC000833323669	600984813	/nfs/dbraw/zinc/98/48/13/600984813.db2.gz	XZGGDKOWVYTYTB-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
Cc1ccc(NC(=O)Cc2c(C)nc(-c3cccnc3)[n-]c2=O)cc1C(=O)[O-]	ZINC000431510059	601109619	/nfs/dbraw/zinc/10/96/19/601109619.db2.gz	FSGDSITWRONOQR-UHFFFAOYSA-N	-2	1	378.388	2.740	20	0		GFADML
Cc1cc(C)c(NS(=O)(=O)c2ccc(F)c(C(=O)[O-])c2F)c(C(=O)[O-])c1	ZINC000738357213	601120261	/nfs/dbraw/zinc/12/02/61/601120261.db2.gz	BONKGEALBRISCM-UHFFFAOYSA-N	-2	1	385.344	2.779	20	0		GFADML
C[C@H](c1ccccc1)[C@H](C)NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000827695264	601184639	/nfs/dbraw/zinc/18/46/39/601184639.db2.gz	PYRHDSIIRKAQIB-GJZGRUSLSA-N	-2	1	393.443	2.715	20	0		GFADML
COC[C@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F	ZINC000831585386	601267778	/nfs/dbraw/zinc/26/77/78/601267778.db2.gz	MVYDZCGBMXCQJW-LBPRGKRZSA-N	-2	1	389.779	2.517	20	0		GFADML
COC(=O)C=Cc1ccc(S(=O)(=O)[N-]c2cccc(NC(=O)[O-])c2)cc1	ZINC000831124154	601324864	/nfs/dbraw/zinc/32/48/64/601324864.db2.gz	MDWSSYKJFPYLMQ-JXMROGBWSA-N	-2	1	376.390	2.764	20	0		GFADML
COC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(C=CC(=O)[O-])cc2)c1	ZINC000831210949	601325113	/nfs/dbraw/zinc/32/51/13/601325113.db2.gz	XMSCZKUAYMRTFQ-YFHOEESVSA-N	-2	1	376.390	2.764	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1Cl	ZINC000515699487	601325952	/nfs/dbraw/zinc/32/59/52/601325952.db2.gz	XKXZTWWNPMVZGI-UHFFFAOYSA-N	-2	1	396.852	2.815	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000829799321	601328043	/nfs/dbraw/zinc/32/80/43/601328043.db2.gz	HFRRWZLSVSCHGI-FLIBITNWSA-N	-2	1	389.433	2.727	20	0		GFADML
CC(=O)N(C)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000745978243	601333604	/nfs/dbraw/zinc/33/36/04/601333604.db2.gz	HBYIORHQUMRSMJ-UHFFFAOYSA-N	-2	1	376.434	2.785	20	0		GFADML
C[C@@H]1CCCN1C(=O)c1ccc(-c2nc3cc(C(=O)[O-])ccc3c(=O)[n-]2)cc1	ZINC000828271562	601397249	/nfs/dbraw/zinc/39/72/49/601397249.db2.gz	FVZHOEBMCHLNDI-GFCCVEGCSA-N	-2	1	377.400	2.913	20	0		GFADML
C/C(=C\COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(F)cc2)c1)C(=O)[O-]	ZINC000825781851	601406124	/nfs/dbraw/zinc/40/61/24/601406124.db2.gz	ZIYKHJOMJIZPAV-FMIVXFBMSA-N	-2	1	393.392	2.814	20	0		GFADML
CC[C@@](C)(CC(=O)[O-])NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000767050162	601460141	/nfs/dbraw/zinc/46/01/41/601460141.db2.gz	ATRXQGWDVVMYHO-IBGZPJMESA-N	-2	1	390.461	2.861	20	0		GFADML
Cc1ccc(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2OC(C)C)cc1C(=O)[O-]	ZINC000443385855	601574876	/nfs/dbraw/zinc/57/48/76/601574876.db2.gz	MAWQJIRRSFFNHT-UHFFFAOYSA-N	-2	1	393.417	2.979	20	0		GFADML
CC[C@H](NC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(C)cc2)c1)C(=O)[O-]	ZINC000485863901	601751101	/nfs/dbraw/zinc/75/11/01/601751101.db2.gz	NPTOVYCKZTZSTP-INIZCTEOSA-N	-2	1	390.461	2.697	20	0		GFADML
C[C@H]1Oc2ccc([N-]S(=O)(=O)c3ccc(Cl)c(C(=O)[O-])c3)cc2NC1=O	ZINC000013032958	601826781	/nfs/dbraw/zinc/82/67/81/601826781.db2.gz	RBFVKUHYCQDHTR-MRVPVSSYSA-N	-2	1	396.808	2.558	20	0		GFADML
COC(=O)Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000029336785	601827450	/nfs/dbraw/zinc/82/74/50/601827450.db2.gz	JKDSKDKVSGTTBV-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2C)ccc1Cl	ZINC000757476455	601827921	/nfs/dbraw/zinc/82/79/21/601827921.db2.gz	GMFASOCFHMOVLI-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])ccc1Cl	ZINC000757475482	601828853	/nfs/dbraw/zinc/82/88/53/601828853.db2.gz	YHQPPPZEYLEABJ-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1	ZINC000829799985	601835779	/nfs/dbraw/zinc/83/57/79/601835779.db2.gz	VWBAFMNHFOWPQQ-UHFFFAOYSA-N	-2	1	398.387	2.522	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3cc(F)c(F)c(C(=O)[O-])c3)c2)n[nH]1	ZINC000370272162	601836223	/nfs/dbraw/zinc/83/62/23/601836223.db2.gz	CDJXAFLQMOALFS-UHFFFAOYSA-N	-2	1	394.359	2.557	20	0		GFADML
Cc1cnn(-c2ccc(S(=O)(=O)[N-]c3ccccc3C(=O)[O-])cc2F)c1	ZINC000544645600	601854072	/nfs/dbraw/zinc/85/40/72/601854072.db2.gz	PANYKWDHAVCYTB-UHFFFAOYSA-N	-2	1	375.381	2.819	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@H]2CCCCCC[C@@H]2C(=O)[O-])c(=O)[n-]1	ZINC000832795295	601914630	/nfs/dbraw/zinc/91/46/30/601914630.db2.gz	YCHBXVFOHJAJQA-KBPBESRZSA-N	-2	1	381.498	2.685	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)cc(C(=O)[O-])c1F	ZINC000763286442	601985658	/nfs/dbraw/zinc/98/56/58/601985658.db2.gz	FTAXHNSMGRDRMP-UHFFFAOYSA-N	-3	1	395.408	2.995	20	0		GFADML
CC[C@H](NC(=O)[O-])C(=O)Nc1ccc(C)c([N-]S(=O)(=O)c2ccccc2)c1	ZINC000739533981	602396933	/nfs/dbraw/zinc/39/69/33/602396933.db2.gz	FLEOMCZCRXVAMD-HNNXBMFYSA-N	-2	1	391.449	2.781	20	0		GFADML
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3ccccc3NC(=O)[O-])cc2C[C@@H]1C	ZINC000738540105	602651758	/nfs/dbraw/zinc/65/17/58/602651758.db2.gz	MUYFBLIPVOFWPJ-NSHDSACASA-N	-2	1	389.433	2.875	20	0		GFADML
COC(=O)c1c(C)cccc1S(=O)(=O)[N-]c1cc(NC(=O)[O-])ccc1F	ZINC000739777089	602654791	/nfs/dbraw/zinc/65/47/91/602654791.db2.gz	BXNDYFILEYVNEY-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(CN(C)C(=O)[O-])c2)c1C	ZINC000739790033	602655669	/nfs/dbraw/zinc/65/56/69/602655669.db2.gz	XFQRHKHUXUXRLL-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2cccc(CNC(=O)[O-])c2)ccc1C	ZINC000738559887	602778984	/nfs/dbraw/zinc/77/89/84/602778984.db2.gz	IAWYZNGPOZYWSY-UHFFFAOYSA-N	-2	1	377.422	2.522	20	0		GFADML
CSc1ccccc1NC(=O)CN(C)C(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000740021405	602841545	/nfs/dbraw/zinc/84/15/45/602841545.db2.gz	SDRLSVXFOVABDT-UHFFFAOYSA-N	-2	1	389.433	2.915	20	0		GFADML
CC(C)(C)OC(=O)N1CCC(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000738707706	602849803	/nfs/dbraw/zinc/84/98/03/602849803.db2.gz	KUMTYRNOOBVCPC-UHFFFAOYSA-N	-2	1	379.413	2.611	20	0		GFADML
CC(C)(C)OC(=O)N1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000738705160	602852507	/nfs/dbraw/zinc/85/25/07/602852507.db2.gz	SIOWXOVVIVECOQ-UHFFFAOYSA-N	-2	1	379.413	2.565	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(NC(=O)CC3CCCC3)CC2)c([O-])c1	ZINC000740699376	602864560	/nfs/dbraw/zinc/86/45/60/602864560.db2.gz	LBBDJDFEMDKNGY-UHFFFAOYSA-N	-2	1	389.452	2.783	20	0		GFADML
O=C([O-])N1CCC[C@H]1C1CCN(Cn2[n-]c(-c3ccccn3)nc2=S)CC1	ZINC000740514257	602992089	/nfs/dbraw/zinc/99/20/89/602992089.db2.gz	BXUPRTRZVPUKFP-HNNXBMFYSA-N	-2	1	388.497	2.815	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])cc1C	ZINC000739792962	603229031	/nfs/dbraw/zinc/22/90/31/603229031.db2.gz	QJZCVNZOFMSFIF-UHFFFAOYSA-N	-2	1	390.417	2.623	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)ccc1C	ZINC000828761227	603528004	/nfs/dbraw/zinc/52/80/04/603528004.db2.gz	QNWGNFYLJYMKHK-LBPRGKRZSA-N	-2	1	392.433	2.911	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CCN1C(=O)OC(C)(C)C	ZINC000826035622	603876684	/nfs/dbraw/zinc/87/66/84/603876684.db2.gz	ZZPXDBSAKCCRAF-NSHDSACASA-N	-2	1	379.413	2.564	20	0		GFADML
CSc1nc(C)c(CCC(=O)Nc2cccc3c2CCN3C(=O)[O-])c(=O)[n-]1	ZINC000829777605	603955173	/nfs/dbraw/zinc/95/51/73/603955173.db2.gz	HKOREQSEAOGHFN-UHFFFAOYSA-N	-2	1	388.449	2.824	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)ccc1NC(=O)[O-]	ZINC000829197115	604312867	/nfs/dbraw/zinc/31/28/67/604312867.db2.gz	FABHXMANEWSAJI-UHFFFAOYSA-N	-3	1	380.378	2.593	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc(OCCCC(=O)[O-])cc2)c1	ZINC000832095616	604633904	/nfs/dbraw/zinc/63/39/04/604633904.db2.gz	HWGOTTXSJFBEMY-UHFFFAOYSA-N	-2	1	395.433	2.748	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])nc2)cc1OC1CCCC1	ZINC000833733274	604688126	/nfs/dbraw/zinc/68/81/26/604688126.db2.gz	KTYCGTXEACOVGK-UHFFFAOYSA-N	-2	1	392.433	2.911	20	0		GFADML
O=C([O-])CCOc1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)cc1	ZINC000507567422	604766397	/nfs/dbraw/zinc/76/63/97/604766397.db2.gz	QGFQCZDOLUOJDG-UHFFFAOYSA-N	-3	1	399.808	2.693	20	0		GFADML
Cc1nnc(-c2cccc([N-]S(=O)(=O)c3ccc(C)c(C(=O)[O-])c3)c2)n1C	ZINC000372074946	604792377	/nfs/dbraw/zinc/79/23/77/604792377.db2.gz	BMYARTIUCNQTOP-UHFFFAOYSA-N	-2	1	386.433	2.598	20	0		GFADML
Cc1nnc(-c2cccc([N-]S(=O)(=O)c3ccc(/C=C/C(=O)[O-])cc3)c2)n1C	ZINC000833017767	604792955	/nfs/dbraw/zinc/79/29/55/604792955.db2.gz	IDVIMGUMUVBJLO-DHZHZOJOSA-N	-2	1	398.444	2.689	20	0		GFADML
CC(C)C1CCC(CNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CC1	ZINC000826726726	604953652	/nfs/dbraw/zinc/95/36/52/604953652.db2.gz	AIWZRHSZHPWLFO-UHFFFAOYSA-N	-2	1	399.491	2.985	20	0		GFADML
CC(C)(C)OC(=O)c1ccc([N-]S(=O)(=O)c2c[nH]c(C(=O)[O-])c2)c(F)c1	ZINC000270638056	605027971	/nfs/dbraw/zinc/02/79/71/605027971.db2.gz	NSXJICHTLLDHTN-UHFFFAOYSA-N	-2	1	384.385	2.608	20	0		GFADML
COCc1ccc(S(=O)(=O)[N-]c2ccc(OCC(=O)[O-])c(Cl)c2)cc1	ZINC000833726097	605042140	/nfs/dbraw/zinc/04/21/40/605042140.db2.gz	RDUXJQOXZWFXIV-UHFFFAOYSA-N	-2	1	385.825	2.751	20	0		GFADML
Cc1ccc([C@@H](C[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)C(=O)[O-])cc1	ZINC000833749939	605293505	/nfs/dbraw/zinc/29/35/05/605293505.db2.gz	ZSPIEEFDNDACQY-LLVKDONJSA-N	-2	1	389.260	2.844	20	0		GFADML
COc1ccc(NC(=O)c2ccc(NC(=O)[O-])c(C)c2)cc1[N-]S(C)(=O)=O	ZINC000829474899	605806025	/nfs/dbraw/zinc/80/60/25/605806025.db2.gz	UOSYOZJMJGSJQA-UHFFFAOYSA-N	-2	1	393.421	2.717	20	0		GFADML
Cc1cnc([C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)C2CC2)s1	ZINC000185066943	655362279	/nfs/dbraw/zinc/36/22/79/655362279.db2.gz	CHXMEFOXGJGVNN-CYBMUJFWSA-N	-2	1	388.417	2.858	20	0		GFADML
Nc1c(Cl)cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2[O-])cc1Cl	ZINC000748671140	655793769	/nfs/dbraw/zinc/79/37/69/655793769.db2.gz	AOLIPZUMWPJFIJ-UHFFFAOYSA-N	-2	1	377.205	2.780	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(O)c2F)c(Br)s1	ZINC000768045145	656231088	/nfs/dbraw/zinc/23/10/88/656231088.db2.gz	CCSRXWCDZIBWRL-UHFFFAOYSA-N	-2	1	396.215	2.854	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(O)cc(F)c2)ccc1Br	ZINC000768054071	656231424	/nfs/dbraw/zinc/23/14/24/656231424.db2.gz	GAIFDBJEHMAQQX-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
COc1cc(Cl)ccc1NS(=O)(=O)c1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000775295980	656625640	/nfs/dbraw/zinc/62/56/40/656625640.db2.gz	XAIMJIUFCWGEDK-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)Cc1ccccc1	ZINC000776561603	656757874	/nfs/dbraw/zinc/75/78/74/656757874.db2.gz	GOIVOOORXPAPHJ-LLVKDONJSA-N	-2	1	389.260	2.610	20	0		GFADML
O=C(COC(=O)c1ccc(Br)c([O-])c1)[N-]OCc1ccccc1	ZINC000778828750	656892488	/nfs/dbraw/zinc/89/24/88/656892488.db2.gz	KXCSAZHCKOYVDH-UHFFFAOYSA-N	-2	1	380.194	2.560	20	0		GFADML
Cc1cc(F)c(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1C[S@@](C)=O	ZINC000793410968	658394030	/nfs/dbraw/zinc/39/40/30/658394030.db2.gz	WFHKWIZIIXJNTG-XMMPIXPASA-N	-2	1	385.438	2.512	20	0		GFADML
Cn1cc([N-]S(=O)(=O)c2c([O-])cccc2OC(F)(F)F)c(C2CC2)n1	ZINC000901933092	663751465	/nfs/dbraw/zinc/75/14/65/663751465.db2.gz	YGSUEENNZDIGCX-UHFFFAOYSA-N	-2	1	377.344	2.703	20	0		GFADML
O=C([O-])[C@@H](C[C@@H]1CCCO1)[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000906002478	663907593	/nfs/dbraw/zinc/90/75/93/663907593.db2.gz	YMZWEHWAPBLGEU-GXSJLCMTSA-N	-2	1	389.882	2.855	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc3c(cc2C(=O)[O-])OCO3)cc1Cl	ZINC000915186959	664423086	/nfs/dbraw/zinc/42/30/86/664423086.db2.gz	GPQYFZOANLSYFY-UHFFFAOYSA-N	-2	1	385.781	2.576	20	0		GFADML
Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(F)cc1[N-]S(C)(=O)=O	ZINC000179766650	552202572	/nfs/dbraw/zinc/20/25/72/552202572.db2.gz	VZANDMBNPWOMCI-UHFFFAOYSA-N	-2	1	392.861	2.960	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(Br)cc2)c(C(=O)[O-])c1	ZINC000316483902	563441455	/nfs/dbraw/zinc/44/14/55/563441455.db2.gz	ASJHOQRCNBARAR-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
O=C([O-])C[C@@H](CC[N-]S(=O)(=O)c1ccc(Cl)cc1F)C(F)(F)F	ZINC000285313375	563514530	/nfs/dbraw/zinc/51/45/30/563514530.db2.gz	ZFGBXHYYMGJPFL-SSDOTTSWSA-N	-2	1	377.743	2.801	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(Br)c(F)c2)cc1O	ZINC000389259593	563522189	/nfs/dbraw/zinc/52/21/89/563522189.db2.gz	DARQWUPBYWVSKG-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
C[C@H]1C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(Cl)c(C(=O)[O-])c3)cc21	ZINC000392296566	563526279	/nfs/dbraw/zinc/52/62/79/563526279.db2.gz	UALYLVVBMMUKGI-MRVPVSSYSA-N	-2	1	380.809	2.895	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)ccc1Cl	ZINC000392991368	563527732	/nfs/dbraw/zinc/52/77/32/563527732.db2.gz	YDKYEKHHVKXAQW-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCC=C(F)C1	ZINC000436810527	563680262	/nfs/dbraw/zinc/68/02/62/563680262.db2.gz	BKARUVMZZWZLNN-UHFFFAOYSA-N	-2	1	382.438	2.954	20	0		GFADML
Cc1cc(C)c(C(=O)[O-])cc1[N-]S(=O)(=O)c1cc(Cl)cc(C(N)=O)c1	ZINC000540983412	564262460	/nfs/dbraw/zinc/26/24/60/564262460.db2.gz	YYGZQFLXPFXHPE-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)CN(C)C(=O)N2	ZINC000547822326	564512180	/nfs/dbraw/zinc/51/21/80/564512180.db2.gz	VQNSMZCJHNOHAS-UHFFFAOYSA-N	-2	1	381.435	2.533	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cccc(F)c1F)Cc1cccc(Cl)c1	ZINC000547873539	564515091	/nfs/dbraw/zinc/51/50/91/564515091.db2.gz	MRBPVSNSVIYURF-LLVKDONJSA-N	-2	1	389.807	2.840	20	0		GFADML
O=C([O-])c1cc(F)cc([N-]S(=O)(=O)c2cncc(Br)c2)c1F	ZINC000548260913	564544345	/nfs/dbraw/zinc/54/43/45/564544345.db2.gz	WSRHYJAQJNUFFF-UHFFFAOYSA-N	-2	1	393.165	2.621	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])s1	ZINC000548525628	564555804	/nfs/dbraw/zinc/55/58/04/564555804.db2.gz	JXNZCZXYWQREPF-UHFFFAOYSA-N	-2	1	389.838	2.616	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1C(=O)[O-])c1nc(C(C)(C)C)no1	ZINC000518972031	564566372	/nfs/dbraw/zinc/56/63/72/564566372.db2.gz	HWQMAPZFBAUBRV-QMMMGPOBSA-N	-2	1	387.845	2.758	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cl)c1C(=O)[O-]	ZINC000523100561	564661973	/nfs/dbraw/zinc/66/19/73/564661973.db2.gz	XPXNUPRERFXQJM-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
COC(=O)c1scc(C)c1S(=O)(=O)[N-]c1c(F)ccc(C)c1C(=O)[O-]	ZINC000527485228	564743791	/nfs/dbraw/zinc/74/37/91/564743791.db2.gz	BCNYNLDLFAOSJX-UHFFFAOYSA-N	-2	1	387.410	2.790	20	0		GFADML
CCCC[C@@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000462407889	564838172	/nfs/dbraw/zinc/83/81/72/564838172.db2.gz	FUCYSDHXAFFGPC-SNVBAGLBSA-N	-2	1	386.214	2.649	20	0		GFADML
O=C([O-])[C@@H]1C=C[C@H]([N-]S(=O)(=O)c2cc(Cl)c(Br)cc2F)C1	ZINC000530354206	564877470	/nfs/dbraw/zinc/87/74/70/564877470.db2.gz	YVGPARGZXIZRAO-RQJHMYQMSA-N	-2	1	398.637	2.549	20	0		GFADML
CC[C@@H](Cc1ccc(NS(=O)(=O)c2csc(C(=O)[O-])c2)cc1)C(=O)[O-]	ZINC000463788052	564889746	/nfs/dbraw/zinc/88/97/46/564889746.db2.gz	IMLWHAJLWXMNRC-NSHDSACASA-N	-2	1	383.447	2.900	20	0		GFADML
COCc1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(OC)cc2C(=O)[O-])c1	ZINC000584264071	564928111	/nfs/dbraw/zinc/92/81/11/564928111.db2.gz	GZDNDZBLTSMGGH-UHFFFAOYSA-N	-2	1	385.825	2.994	20	0		GFADML
CC(C)C[C@@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000534800251	564996086	/nfs/dbraw/zinc/99/60/86/564996086.db2.gz	QZORKHGZYVOERM-SNVBAGLBSA-N	-2	1	386.214	2.505	20	0		GFADML
COC(=O)[C@H](C)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)cc1	ZINC000562735108	565040474	/nfs/dbraw/zinc/04/04/74/565040474.db2.gz	BJSCOFYXZJYQTJ-SECBINFHSA-N	-2	1	383.447	2.832	20	0		GFADML
CC(C)=CCSC[C@H]([N-]S(=O)(=O)c1ncccc1C(F)(F)F)C(=O)[O-]	ZINC000593257062	565323089	/nfs/dbraw/zinc/32/30/89/565323089.db2.gz	QKRUFIVAIKHBCV-NSHDSACASA-N	-2	1	398.428	2.531	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](CC2CCCCC2)C(=O)[O-])c(F)c1	ZINC000669838581	565704474	/nfs/dbraw/zinc/70/44/74/565704474.db2.gz	IAQKQSNWDLFBDW-CQSZACIVSA-N	-2	1	377.409	2.675	20	0		GFADML
COC1(C[C@H]([N-]S(=O)(=O)c2cc(Cl)sc2Cl)C(=O)[O-])CCC1	ZINC000650431904	565821245	/nfs/dbraw/zinc/82/12/45/565821245.db2.gz	GYVWNBBKBSIQPE-ZETCQYMHSA-N	-2	1	388.294	2.746	20	0		GFADML
Cc1cc(C)c([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(Cl)c2)cc1O	ZINC000680809759	566083202	/nfs/dbraw/zinc/08/32/02/566083202.db2.gz	NNCCAVRZBXKQDO-UHFFFAOYSA-N	-2	1	385.825	2.927	20	0		GFADML
Cc1ccc(NC(=O)CCCNC(=O)[O-])cc1[N-]S(=O)(=O)c1ccccc1	ZINC000738614977	599746777	/nfs/dbraw/zinc/74/67/77/599746777.db2.gz	IWZHZHIHKZRXJR-UHFFFAOYSA-N	-2	1	391.449	2.782	20	0		GFADML
C[C@H](CNC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1)C(=O)[O-]	ZINC000736605542	599780964	/nfs/dbraw/zinc/78/09/64/599780964.db2.gz	IGBMZWYKWHIJTR-LLVKDONJSA-N	-2	1	396.852	2.591	20	0		GFADML
O=C([O-])c1cc2c(c(S(=O)(=O)[N-]c3cccc(F)c3C(=O)[O-])c1)CCCC2	ZINC000518646758	599852016	/nfs/dbraw/zinc/85/20/16/599852016.db2.gz	KSIMWEYAYQZGFF-UHFFFAOYSA-N	-3	1	393.392	2.902	20	0		GFADML
CCn1cnnc1-c1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)c1	ZINC000477410346	599906665	/nfs/dbraw/zinc/90/66/65/599906665.db2.gz	DPFWBGKWONSLTN-UHFFFAOYSA-N	-2	1	386.433	2.772	20	0		GFADML
Cc1cc(=O)[nH]c(-c2ccc([N-]S(=O)(=O)c3cccc(C(=O)[O-])c3C)cc2)n1	ZINC000378156464	599907288	/nfs/dbraw/zinc/90/72/88/599907288.db2.gz	AJKCNIAPKVPHRE-UHFFFAOYSA-N	-2	1	399.428	2.553	20	0		GFADML
COC(=O)Nc1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)ccc1F	ZINC000737641414	599908116	/nfs/dbraw/zinc/90/81/16/599908116.db2.gz	DCUCBYFQVPBVFD-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
CCC[C@](C)([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000736960738	599981267	/nfs/dbraw/zinc/98/12/67/599981267.db2.gz	YLTWBSDUORHXSH-LBPRGKRZSA-N	-2	1	386.214	2.649	20	0		GFADML
COCCOc1ccc(S(=O)(=O)[N-]c2cc(OC)ccc2C(=O)[O-])cc1C	ZINC000516670982	600005978	/nfs/dbraw/zinc/00/59/78/600005978.db2.gz	RAFKYNRWJKDVLV-UHFFFAOYSA-N	-2	1	395.433	2.528	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(C)cc2)c1	ZINC000485331677	600025048	/nfs/dbraw/zinc/02/50/48/600025048.db2.gz	FJIUDAWNRIZZIW-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(C)c2)cc1	ZINC000737076588	600025638	/nfs/dbraw/zinc/02/56/38/600025638.db2.gz	VZUIOCBTVOCSCG-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1cccc(Cn2cccn2)c1	ZINC000740146766	600097157	/nfs/dbraw/zinc/09/71/57/600097157.db2.gz	VAMWWEPCOGHSAW-UHFFFAOYSA-N	-2	1	375.381	2.570	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(NC(=O)[C@H]3C[C@H]3C(=O)[O-])ccc2C)c1	ZINC000262592756	600102871	/nfs/dbraw/zinc/10/28/71/600102871.db2.gz	IEJYVPXGIYOTGZ-JKSUJKDBSA-N	-2	1	388.445	2.763	20	0		GFADML
CCn1cnnc1-c1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1C	ZINC000466329304	600231737	/nfs/dbraw/zinc/23/17/37/600231737.db2.gz	YUEJTUCQVOLJBU-UHFFFAOYSA-N	-2	1	386.433	2.772	20	0		GFADML
O=C([O-])CCOc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])cc1	ZINC000739743775	600383595	/nfs/dbraw/zinc/38/35/95/600383595.db2.gz	VVGTXHWPBPUSLB-UHFFFAOYSA-N	-3	1	399.808	2.693	20	0		GFADML
Cc1noc(COc2ccc([N-]S(=O)(=O)c3ccsc3C(=O)[O-])cc2)n1	ZINC000738951379	600412776	/nfs/dbraw/zinc/41/27/76/600412776.db2.gz	UNSHBMWLXMHCDS-UHFFFAOYSA-N	-2	1	395.418	2.518	20	0		GFADML
Cc1cccc2c1CCCN2C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000738748322	600424716	/nfs/dbraw/zinc/42/47/16/600424716.db2.gz	STOAVGXCLSHDQP-UHFFFAOYSA-N	-2	1	391.427	2.694	20	0		GFADML
O=C([O-])c1ccnc([N-]S(=O)(=O)/C=C/c2ccc(Br)cc2)c1	ZINC000740249228	600577090	/nfs/dbraw/zinc/57/70/90/600577090.db2.gz	RVALEYPHEXALJB-SOFGYWHQSA-N	-2	1	383.223	2.955	20	0		GFADML
C[C@@H]1CCC[C@H](CCNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736775201	600622240	/nfs/dbraw/zinc/62/22/40/600622240.db2.gz	NBJQDMGKHROLLS-HUUCEWRRSA-N	-2	1	385.464	2.739	20	0		GFADML
COc1ccc(-c2nc(C(=O)[N-]c3nnc(CCC(=O)[O-])s3)cs2)cc1	ZINC000737913020	600629451	/nfs/dbraw/zinc/62/94/51/600629451.db2.gz	WQFNBFIUZMKNNN-UHFFFAOYSA-N	-2	1	390.446	2.940	20	0		GFADML
CC(=O)N1CCc2cc(S(=O)(=O)[N-]c3cc(Cl)cc(C(=O)[O-])c3)ccc21	ZINC000736139068	600638033	/nfs/dbraw/zinc/63/80/33/600638033.db2.gz	OWCYTPIOMRCSFB-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
O=C([O-])c1cc(NS(=O)(=O)c2ccc(F)c(C(=O)[O-])c2F)ccc1Cl	ZINC000327028474	601119841	/nfs/dbraw/zinc/11/98/41/601119841.db2.gz	UNYIYXNGKWYIHY-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(O[C@H]3CCCC[C@@H]3O)cc2)cs1	ZINC000555460808	601203706	/nfs/dbraw/zinc/20/37/06/601203706.db2.gz	PPHZSAAJFGYNGN-GJZGRUSLSA-N	-2	1	397.474	2.929	20	0		GFADML
COc1cc(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2C)c(Cl)cc1C(=O)[O-]	ZINC000832097790	601224473	/nfs/dbraw/zinc/22/44/73/601224473.db2.gz	MQHPVKGJVDVHKV-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
COc1cc(C)c([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1OC	ZINC000013347533	601318960	/nfs/dbraw/zinc/31/89/60/601318960.db2.gz	MTQPOOZYDHRFOJ-RMKNXTFCSA-N	-2	1	377.418	2.911	20	0		GFADML
COCCOc1cccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000831783135	601324914	/nfs/dbraw/zinc/32/49/14/601324914.db2.gz	FJTLUSZFCRXIOP-YFHOEESVSA-N	-2	1	377.418	2.610	20	0		GFADML
COC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(C=CC(=O)[O-])cc2)cc1	ZINC000831210099	601324985	/nfs/dbraw/zinc/32/49/85/601324985.db2.gz	LNDNGEHVZMJIKC-NYYWCZLTSA-N	-2	1	376.390	2.764	20	0		GFADML
COC(=O)C=Cc1ccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)cc1	ZINC000831123764	601328780	/nfs/dbraw/zinc/32/87/80/601328780.db2.gz	DQOWVFFNMMESEZ-WTKPLQERSA-N	-2	1	394.380	2.903	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000829852930	601332769	/nfs/dbraw/zinc/33/27/69/601332769.db2.gz	VXFKRYLOEWDVFP-DHZHZOJOSA-N	-2	1	389.429	2.691	20	0		GFADML
Cc1cc(C)c(C(=O)[O-])c([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000832871950	601335417	/nfs/dbraw/zinc/33/54/17/601335417.db2.gz	FBWJLDBEDSXKDZ-VMPITWQZSA-N	-3	1	375.402	2.900	20	0		GFADML
O=C([O-])CC1(NC(=O)c2cccc([N-]S(=O)(=O)c3ccccc3)c2)CCC1	ZINC000262414633	601436926	/nfs/dbraw/zinc/43/69/26/601436926.db2.gz	BSYQQPUYMRCSHV-UHFFFAOYSA-N	-2	1	388.445	2.615	20	0		GFADML
CC(C)Oc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(CC(=O)[O-])cc1	ZINC000443368291	601574974	/nfs/dbraw/zinc/57/49/74/601574974.db2.gz	FHTZTSFDYOBMMP-UHFFFAOYSA-N	-2	1	393.417	2.600	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)[O-])c1	ZINC000443355253	601575789	/nfs/dbraw/zinc/57/57/89/601575789.db2.gz	BOOMBDVVHZQETN-UHFFFAOYSA-N	-2	1	379.390	2.673	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@@H](C(=O)[O-])c2ccc(Cl)cc2)c(=O)[n-]1	ZINC000832795111	601586790	/nfs/dbraw/zinc/58/67/90/601586790.db2.gz	UEJSJMMXCJCNJS-CQSZACIVSA-N	-2	1	395.868	2.741	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@H](C(=O)[O-])c2ccc(Cl)cc2)c(=O)[n-]1	ZINC000832795110	601586864	/nfs/dbraw/zinc/58/68/64/601586864.db2.gz	UEJSJMMXCJCNJS-AWEZNQCLSA-N	-2	1	395.868	2.741	20	0		GFADML
CC[C@@H](NC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C)c(F)c2)c1)C(=O)[O-]	ZINC000485874516	601750904	/nfs/dbraw/zinc/75/09/04/601750904.db2.gz	JALKTOZLCVKZMX-MRXNPFEDSA-N	-2	1	394.424	2.528	20	0		GFADML
CC[C@@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(C)c2C)cc1)C(=O)[O-]	ZINC000262502821	601752707	/nfs/dbraw/zinc/75/27/07/601752707.db2.gz	NUGRNGALOYYLCR-MRXNPFEDSA-N	-2	1	390.461	2.697	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])n(C)c2)c(C)cc1Br	ZINC000832903785	601783760	/nfs/dbraw/zinc/78/37/60/601783760.db2.gz	ULNQJMONJZAGTJ-UHFFFAOYSA-N	-2	1	387.255	2.903	20	0		GFADML
CCOc1cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)ccc1OC	ZINC000751144469	601835444	/nfs/dbraw/zinc/83/54/44/601835444.db2.gz	CDLZGJKOJBFKFL-UHFFFAOYSA-N	-2	1	387.360	2.871	20	0		GFADML
CC1(C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccc(F)c(NC(=O)[O-])c3)cc21	ZINC000828046264	601839955	/nfs/dbraw/zinc/83/99/55/601839955.db2.gz	SRTJETGJEVSHRG-UHFFFAOYSA-N	-2	1	393.396	2.946	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)n(-c2ccncc2)n1	ZINC000832899786	601843811	/nfs/dbraw/zinc/84/38/11/601843811.db2.gz	QOJDUJXOFRKDAZ-UHFFFAOYSA-N	-2	1	392.824	2.728	20	0		GFADML
CCc1cc2c(COC(=O)CC3CCN(C(=O)[O-])CC3)cc(=O)oc2cc1[O-]	ZINC000739542603	602284561	/nfs/dbraw/zinc/28/45/61/602284561.db2.gz	JNEHAQNUAYWZKP-UHFFFAOYSA-N	-2	1	389.404	2.884	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)ccc1Cl	ZINC000754759267	602320979	/nfs/dbraw/zinc/32/09/79/602320979.db2.gz	QTXRBWNSFHLCOW-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CN(C(=O)[O-])CC3)cc1F	ZINC000739933909	602490792	/nfs/dbraw/zinc/49/07/92/602490792.db2.gz	VCQGBTUFYRBTOC-UHFFFAOYSA-N	-2	1	380.397	2.671	20	0		GFADML
COc1cccc(-c2nsc([N-]C(=O)c3csc(CNC(=O)[O-])n3)n2)c1	ZINC000739942949	602702818	/nfs/dbraw/zinc/70/28/18/602702818.db2.gz	NIFNDVVNSOYGID-UHFFFAOYSA-N	-2	1	391.434	2.690	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])cc1	ZINC000738509040	602819513	/nfs/dbraw/zinc/81/95/13/602819513.db2.gz	LSQNKUYKEMMIPZ-UHFFFAOYSA-N	-2	1	389.433	2.511	20	0		GFADML
CN(C(=O)[O-])[C@@H]1CCCN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1	ZINC000739583105	602858656	/nfs/dbraw/zinc/85/86/56/602858656.db2.gz	DNNVWXCLQRDAFH-CYBMUJFWSA-N	-2	1	393.440	2.954	20	0		GFADML
CN(C)[C@H](CNC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1c(F)cccc1F	ZINC000739607338	602865593	/nfs/dbraw/zinc/86/55/93/602865593.db2.gz	JHRCNFLTCWZNSY-CQSZACIVSA-N	-2	1	379.363	2.793	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)cc1	ZINC000828789197	603400860	/nfs/dbraw/zinc/40/08/60/603400860.db2.gz	RDUPTWCFWWADGI-LLVKDONJSA-N	-2	1	378.406	2.603	20	0		GFADML
CC(C)(CNC(=O)[O-])C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000823970072	603631506	/nfs/dbraw/zinc/63/15/06/603631506.db2.gz	ZGAUXVSKKZPATK-UHFFFAOYSA-N	-2	1	391.449	2.720	20	0		GFADML
CC(C)(CNC(=O)[O-])C(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000823969210	603631612	/nfs/dbraw/zinc/63/16/12/603631612.db2.gz	HZQDGPSYRJEORP-UHFFFAOYSA-N	-2	1	391.449	2.720	20	0		GFADML
CC(=O)c1ccc([O-])c(CCOC(=O)CC2C[C@H]3CC[C@@H](C2)N3C(=O)[O-])c1	ZINC000823635787	603807184	/nfs/dbraw/zinc/80/71/84/603807184.db2.gz	IOEKUNLBXBNJSK-FUCXHRTASA-N	-2	1	375.421	2.992	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)Nc1cccc2c1CCN2C(=O)[O-]	ZINC000830957336	604015747	/nfs/dbraw/zinc/01/57/47/604015747.db2.gz	OXMMWDHTCQYPIP-UHFFFAOYSA-N	-2	1	382.419	2.596	20	0		GFADML
COc1cc(CC2CN(C(=O)c3ccc(NC(=O)[O-])cc3[O-])C2)cc(OC)c1	ZINC000829110004	604098567	/nfs/dbraw/zinc/09/85/67/604098567.db2.gz	NYADEFWTUYCEHF-UHFFFAOYSA-N	-2	1	386.404	2.814	20	0		GFADML
C[C@@]1([N-]S(=O)(=O)c2sccc2Br)CCCC[C@@H]1C(=O)[O-]	ZINC000833572480	604808191	/nfs/dbraw/zinc/80/81/91/604808191.db2.gz	SXSRQIKOCLVTII-PRHODGIISA-N	-2	1	382.301	2.822	20	0		GFADML
C[C@]1([N-]S(=O)(=O)c2sccc2Br)CCCC[C@@H]1C(=O)[O-]	ZINC000833572479	604808422	/nfs/dbraw/zinc/80/84/22/604808422.db2.gz	SXSRQIKOCLVTII-PELKAZGASA-N	-2	1	382.301	2.822	20	0		GFADML
C[C@@H]1CCCN(c2nc([O-])c(CC(=O)Nc3ccsc3C(=O)[O-])s2)C1	ZINC000833615056	604999740	/nfs/dbraw/zinc/99/97/40/604999740.db2.gz	ZSMUAFQCGWAEDH-KOLCDFICSA-N	-2	1	381.479	2.505	20	0		GFADML
Cc1c(C(=O)[O-])csc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1Cl	ZINC000833741660	605127412	/nfs/dbraw/zinc/12/74/12/605127412.db2.gz	SNVZSLJWNPKTOG-UHFFFAOYSA-N	-2	1	375.811	2.907	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1C(=O)[O-])c1nc(C2CC2)no1	ZINC000833472511	605172200	/nfs/dbraw/zinc/17/22/00/605172200.db2.gz	YZDLNYSGSCVROX-ZDUSSCGKSA-N	-2	1	399.856	2.974	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)cc2C(=O)[O-])cc1Cl	ZINC000833699817	605186482	/nfs/dbraw/zinc/18/64/82/605186482.db2.gz	AFWKTPCYGHLNFE-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
CC(=O)N1CCc2ccc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])c(F)c3)cc21	ZINC000833392474	605263865	/nfs/dbraw/zinc/26/38/65/605263865.db2.gz	UBYCHDHEXWLGTA-UHFFFAOYSA-N	-2	1	393.396	2.625	20	0		GFADML
O=C([O-])N[C@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1ccccc1	ZINC000834149823	605402517	/nfs/dbraw/zinc/40/25/17/605402517.db2.gz	JBIBGFIMDIXGQJ-LLVKDONJSA-N	-2	1	390.248	2.676	20	0		GFADML
Cc1c(Cl)cccc1S(=O)(=O)[N-]c1nn(C(C)(C)C)cc1-c1nn[n-]n1	ZINC000822035281	606622119	/nfs/dbraw/zinc/62/21/19/606622119.db2.gz	RTMTZDFOFNYDMS-UHFFFAOYSA-N	-2	1	395.876	2.581	20	0		GFADML
Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cc2c(cc1C(=O)[O-])OCCO2	ZINC000031667237	654597711	/nfs/dbraw/zinc/59/77/11/654597711.db2.gz	KRNOOWLMQNFGDV-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
CN(C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])[C@H]1CCSC1	ZINC000270230087	655038055	/nfs/dbraw/zinc/03/80/55/655038055.db2.gz	MAIZBIHLNWMPPY-LBPRGKRZSA-N	-2	1	398.531	2.832	20	0		GFADML
CSCC[C@@H]([N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C(=O)[O-]	ZINC000274918484	655207141	/nfs/dbraw/zinc/20/71/41/655207141.db2.gz	MJUJOMZBZPWRAY-SECBINFHSA-N	-2	1	391.820	2.843	20	0		GFADML
O=C([O-])[C@H](CC(F)F)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000275341166	655230591	/nfs/dbraw/zinc/23/05/91/655230591.db2.gz	VEOUAQOEILNIJK-ZETCQYMHSA-N	-2	1	381.706	2.746	20	0		GFADML
Cc1cnc([C@@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)C2CC2)s1	ZINC000185066960	655362265	/nfs/dbraw/zinc/36/22/65/655362265.db2.gz	CHXMEFOXGJGVNN-ZDUSSCGKSA-N	-2	1	388.417	2.858	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2c(C)cccc2C(=O)[O-])ccc1Cl	ZINC000757475444	655911745	/nfs/dbraw/zinc/91/17/45/655911745.db2.gz	XJFHLXZVYUBFFM-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
C[S@@](=O)Cc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1	ZINC000762452901	656042518	/nfs/dbraw/zinc/04/25/18/656042518.db2.gz	INHHGWWZPFHVCX-HSZRJFAPSA-N	-2	1	387.866	2.718	20	0		GFADML
O=C([O-])c1cccc(CC[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)c1	ZINC000776483167	656745841	/nfs/dbraw/zinc/74/58/41/656745841.db2.gz	CGJGZKNMPOWCRM-UHFFFAOYSA-N	-2	1	375.233	2.608	20	0		GFADML
COc1ccccc1[C@@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)C(=O)[O-]	ZINC000776520679	656750180	/nfs/dbraw/zinc/75/01/80/656750180.db2.gz	PBFVGWKQCJKNBC-LLVKDONJSA-N	-2	1	391.232	2.501	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)CC1CCCC1	ZINC000776553574	656756649	/nfs/dbraw/zinc/75/66/49/656756649.db2.gz	XLVDQSMEKJABLM-JTQLQIEISA-N	-2	1	381.281	2.948	20	0		GFADML
CC(C)(C)C[C@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000776552361	656756670	/nfs/dbraw/zinc/75/66/70/656756670.db2.gz	QQPVDOUGJJMILN-QMMMGPOBSA-N	-2	1	399.694	2.665	20	0		GFADML
C[C@H](CC[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000776587987	656763565	/nfs/dbraw/zinc/76/35/65/656763565.db2.gz	BWKKWTLUUKZLSE-RXMQYKEDSA-N	-2	1	376.681	2.553	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)[C@H](O)c1ccccc1	ZINC000776599832	656765124	/nfs/dbraw/zinc/76/51/24/656765124.db2.gz	HKGMCZNPKBYQPV-WDEREUQCSA-N	-2	1	396.273	2.520	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(O)c2F)c(F)c(Cl)c1F	ZINC000779842682	656948845	/nfs/dbraw/zinc/94/88/45/656948845.db2.gz	RSRLJYGCPNELQM-UHFFFAOYSA-N	-2	1	381.715	2.962	20	0		GFADML
COc1cc(O)cc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)c1	ZINC000779847186	656949466	/nfs/dbraw/zinc/94/94/66/656949466.db2.gz	WEHOBZKXNRIEPY-UHFFFAOYSA-N	-2	1	375.761	2.692	20	0		GFADML
CO[C@H]1Cc2ccc([N-]S(=O)(=O)c3ccc(Cl)c(C(=O)[O-])c3)cc2C1	ZINC000783861608	657265860	/nfs/dbraw/zinc/26/58/60/657265860.db2.gz	IICBJBJIVNZDPN-ZDUSSCGKSA-N	-2	1	381.837	2.953	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)OC3)cc(C(=O)[O-])c1Cl	ZINC000808124956	659878954	/nfs/dbraw/zinc/87/89/54/659878954.db2.gz	BVRCCUXPEPBJRU-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
CCC[C@H](C(=O)OCC)S(=O)(=O)[N-]c1ccc(S[C@@H](C)C(=O)[O-])cc1	ZINC000844662123	661432652	/nfs/dbraw/zinc/43/26/52/661432652.db2.gz	MBABBNPDVZYSNE-SMDDNHRTSA-N	-2	1	389.495	2.725	20	0		GFADML
C[C@@]1(C(=O)[O-])C[C@H]([N-]S(=O)(=O)c2sc3ccccc3c2Cl)CCO1	ZINC000906011272	663908500	/nfs/dbraw/zinc/90/85/00/663908500.db2.gz	RHCXHZCCQAYVMJ-PSLIRLAXSA-N	-2	1	389.882	2.855	20	0		GFADML
COc1cc(C(=O)N2CCC(C(=O)[O-])(C(F)(F)F)CC2)cc(Cl)c1[O-]	ZINC000911018203	664233362	/nfs/dbraw/zinc/23/33/62/664233362.db2.gz	VDVQRNDLGDWFIT-UHFFFAOYSA-N	-2	1	381.734	2.924	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)cc1Cl	ZINC000054795618	551170335	/nfs/dbraw/zinc/17/03/35/551170335.db2.gz	OFTIFTIKSRNXSG-UHFFFAOYSA-N	-3	1	385.781	2.546	20	0		GFADML
CC(C)C[C@@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000261755631	553157821	/nfs/dbraw/zinc/15/78/21/553157821.db2.gz	WWJKTYCLQFIRCD-ZCFIWIBFSA-N	-2	1	390.708	2.942	20	0		GFADML
O=C([O-])CCC[N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl	ZINC000262423768	553170818	/nfs/dbraw/zinc/17/08/18/553170818.db2.gz	VJTJMLJNICSWQY-UHFFFAOYSA-N	-2	1	391.070	2.899	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccc2oc(=O)[nH]c2c1	ZINC000327072297	563456797	/nfs/dbraw/zinc/45/67/97/563456797.db2.gz	CSJJAJWEAGYVCU-UHFFFAOYSA-N	-2	1	382.781	2.582	20	0		GFADML
COCCOc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000327719893	563459116	/nfs/dbraw/zinc/45/91/16/563459116.db2.gz	DLBQNTCSHBMVJC-UHFFFAOYSA-N	-2	1	385.825	2.864	20	0		GFADML
O=C(N[C@@H]1CC[C@@H](F)C1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436744169	563679045	/nfs/dbraw/zinc/67/90/45/563679045.db2.gz	KBOLLTXNGLFZIN-GHMZBOCLSA-N	-2	1	384.454	2.875	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(-c3ncon3)c2)ccc1Cl	ZINC000363593936	563727650	/nfs/dbraw/zinc/72/76/50/563727650.db2.gz	SRSPIMVAXGYCIH-UHFFFAOYSA-N	-2	1	379.781	2.889	20	0		GFADML
CCOC(=O)CC1(S(=O)(=O)[N-]c2cc(C)cc(Br)c2[O-])CC1	ZINC000414381100	563731585	/nfs/dbraw/zinc/73/15/85/563731585.db2.gz	KWKQZNJSEHPGNT-UHFFFAOYSA-N	-2	1	392.271	2.691	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccc(S(=O)(=O)N[C@@]2(C)CC=CCC2)c(F)c1	ZINC000416560809	563848237	/nfs/dbraw/zinc/84/82/37/563848237.db2.gz	RLHIBIBMJYDJJN-INIZCTEOSA-N	-2	1	390.502	2.755	20	0		GFADML
CC(C)(CC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br	ZINC000567423721	564371206	/nfs/dbraw/zinc/37/12/06/564371206.db2.gz	OCMLGOWXLXOBBG-UHFFFAOYSA-N	-2	1	388.642	2.773	20	0		GFADML
Cc1cc(C)c(S(=O)(=O)[N-]c2ccccc2C[S@](C)=O)cc1C(=O)[O-]	ZINC000547240540	564480418	/nfs/dbraw/zinc/48/04/18/564480418.db2.gz	YZQUGVQPOXJPRW-DEOSSOPVSA-N	-2	1	381.475	2.681	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C)c2)c1	ZINC000547548036	564493674	/nfs/dbraw/zinc/49/36/74/564493674.db2.gz	BHVVTFIFODPFQH-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2[O-])ccc1Br	ZINC000481465498	564513654	/nfs/dbraw/zinc/51/36/54/564513654.db2.gz	KILMBLQHADPBKQ-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)Nc2cccc(Cl)c2C(=O)[O-])ccc1[O-]	ZINC000481608906	564517929	/nfs/dbraw/zinc/51/79/29/564517929.db2.gz	GFYRIAJCBHFDKB-UHFFFAOYSA-N	-2	1	384.797	2.503	20	0		GFADML
COc1ccc(Br)c(C(=O)[O-])c1[N-]S(=O)(=O)CCC1CC1	ZINC000547931500	564522047	/nfs/dbraw/zinc/52/20/47/564522047.db2.gz	BIMGBKFPACWFDJ-UHFFFAOYSA-N	-2	1	378.244	2.698	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C1CCC1	ZINC000548596950	564565337	/nfs/dbraw/zinc/56/53/37/564565337.db2.gz	XVXUYBOCKSNRSU-MRVPVSSYSA-N	-2	1	388.692	2.696	20	0		GFADML
COc1cccc(C[C@H](C[N-]S(=O)(=O)c2sccc2Cl)C(=O)[O-])c1	ZINC000572362177	564591176	/nfs/dbraw/zinc/59/11/76/564591176.db2.gz	KDQGHJOWOLNVSL-LLVKDONJSA-N	-2	1	389.882	2.632	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000484813505	564599414	/nfs/dbraw/zinc/59/94/14/564599414.db2.gz	OYEJWDWLWMOCDT-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])s1	ZINC000551116640	564638113	/nfs/dbraw/zinc/63/81/13/564638113.db2.gz	YNAJAUCOZAKJEW-UHFFFAOYSA-N	-2	1	375.811	2.687	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C[S@@](C)=O)c1C	ZINC000522597202	564652882	/nfs/dbraw/zinc/65/28/82/564652882.db2.gz	UJEKBPIXWORMHG-HSZRJFAPSA-N	-2	1	387.504	2.742	20	0		GFADML
COc1ccc(F)c([N-]S(=O)(=O)c2cc(OC)c(C(=O)[O-])cc2Cl)c1	ZINC000531527314	564912560	/nfs/dbraw/zinc/91/25/60/564912560.db2.gz	PJZTUDDCRVVKON-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
CCSCc1ccnc([N-]S(=O)(=O)c2ccc([O-])c(C(=O)OC)c2)c1	ZINC000534907456	564999541	/nfs/dbraw/zinc/99/95/41/564999541.db2.gz	WNTNGEATIKFROF-UHFFFAOYSA-N	-2	1	382.463	2.628	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]C[C@H](c2ccccc2)C(F)(F)F)oc1C(=O)[O-]	ZINC000663424602	565419957	/nfs/dbraw/zinc/41/99/57/565419957.db2.gz	MWHKNZWTUONOCS-LLVKDONJSA-N	-2	1	377.340	2.911	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)cc2c1OCCO2	ZINC000674232950	565865179	/nfs/dbraw/zinc/86/51/79/565865179.db2.gz	GFCMSLIJZMYAPK-UHFFFAOYSA-N	-2	1	387.772	2.749	20	0		GFADML
CN(C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])c1nccs1	ZINC000604790835	565938441	/nfs/dbraw/zinc/93/84/41/565938441.db2.gz	XUBGISJKAJUZLP-UHFFFAOYSA-N	-2	1	395.487	2.988	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H]2CCCC[C@H]2CCC(=O)[O-])c(F)c1	ZINC000654779528	566022021	/nfs/dbraw/zinc/02/20/21/566022021.db2.gz	QADHOSHGYZMIJP-HZMBPMFUSA-N	-2	1	377.409	2.675	20	0		GFADML
CC(C)c1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1CC(=O)[O-]	ZINC000817985948	597312936	/nfs/dbraw/zinc/31/29/36/597312936.db2.gz	LDSVTZGKTJJKDA-UHFFFAOYSA-N	-3	1	377.418	2.936	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccc(CCC(=O)[O-])cc1	ZINC000540703967	599771913	/nfs/dbraw/zinc/77/19/13/599771913.db2.gz	UJUNDNMFGFETEP-UHFFFAOYSA-N	-2	1	376.434	2.718	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)NC[C@@H](C)C(=O)[O-])c1	ZINC000262487372	599775566	/nfs/dbraw/zinc/77/55/66/599775566.db2.gz	FPVJEIHKFGUNEX-CQSZACIVSA-N	-2	1	390.461	2.555	20	0		GFADML
N#Cc1cc([N-]S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)ccc1F	ZINC000320296424	599849528	/nfs/dbraw/zinc/84/95/28/599849528.db2.gz	RFEOLJFYXSNFEX-UHFFFAOYSA-N	-2	1	399.197	2.959	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@H](CCC(=O)[O-])c2ccccc2)c(=O)[n-]1	ZINC000738210276	599934591	/nfs/dbraw/zinc/93/45/91/599934591.db2.gz	REMUPWRBGDRBNU-OAHLLOKOSA-N	-2	1	389.477	2.867	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(NC(=O)NC2CC2)cc1	ZINC000739474842	600094753	/nfs/dbraw/zinc/09/47/53/600094753.db2.gz	HCCCTNMCGWQLBY-UHFFFAOYSA-N	-2	1	393.396	2.609	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)cc1	ZINC000737030115	600302205	/nfs/dbraw/zinc/30/22/05/600302205.db2.gz	QFLRTBQXNIXLJG-UHFFFAOYSA-N	-2	1	392.433	2.822	20	0		GFADML
Cc1ccc(C[C@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)s1	ZINC000738588970	600413905	/nfs/dbraw/zinc/41/39/05/600413905.db2.gz	HWQKHJMQWZRUHX-LBPRGKRZSA-N	-2	1	399.472	2.524	20	0		GFADML
Cc1ccc([C@H](C)CNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)cc1	ZINC000738551574	600413969	/nfs/dbraw/zinc/41/39/69/600413969.db2.gz	KBEZKRUBFDLSLU-OAHLLOKOSA-N	-2	1	393.443	2.635	20	0		GFADML
Cc1cccc([C@@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1C	ZINC000738689641	600623679	/nfs/dbraw/zinc/62/36/79/600623679.db2.gz	DSHMIRXRKRFYNM-OAHLLOKOSA-N	-2	1	393.443	2.901	20	0		GFADML
CN(C)C(=O)Sc1ccc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)cc1	ZINC000737352519	600628724	/nfs/dbraw/zinc/62/87/24/600628724.db2.gz	OFQPQIATUWZTFK-UHFFFAOYSA-N	-2	1	394.474	2.888	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)cc1	ZINC000737631284	600637738	/nfs/dbraw/zinc/63/77/38/600637738.db2.gz	SNACVZRXUFGNEB-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cc(Cl)cc(C(=O)[O-])c1	ZINC000738291773	600637847	/nfs/dbraw/zinc/63/78/47/600637847.db2.gz	YHZUPATVWJFBBX-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])c1cc(Cl)cc([N-]S(=O)(=O)c2ccc3oc(=O)ccc3c2)c1	ZINC000392712064	600637959	/nfs/dbraw/zinc/63/79/59/600637959.db2.gz	VEMOWQUUMVIVON-UHFFFAOYSA-N	-2	1	379.777	2.945	20	0		GFADML
COC(=O)c1cc(Cl)cc([N-]S(=O)(=O)c2ccc(CC(=O)[O-])cc2)c1	ZINC000737654913	600638021	/nfs/dbraw/zinc/63/80/21/600638021.db2.gz	ZHFVCCWYCQUIGC-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
CCCc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C(=O)OC)c2)cc1	ZINC000829566684	600687764	/nfs/dbraw/zinc/68/77/64/600687764.db2.gz	RZNDRWIXLKPBBG-UHFFFAOYSA-N	-2	1	377.418	2.925	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(C)c(OC)cc2C)cc1C(=O)[O-]	ZINC000831434887	600689450	/nfs/dbraw/zinc/68/94/50/600689450.db2.gz	IRZKFUPFKXYWSW-UHFFFAOYSA-N	-2	1	393.417	2.598	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1Cl)c1nc(C(C)(C)C)no1	ZINC000827746616	600800605	/nfs/dbraw/zinc/80/06/05/600800605.db2.gz	FHGZACKXDWUEKM-QMMMGPOBSA-N	-2	1	387.845	2.758	20	0		GFADML
CC(=O)N(C)c1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])c1	ZINC000825823945	600817581	/nfs/dbraw/zinc/81/75/81/600817581.db2.gz	XPIJEXJMEMCWGG-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(-n3cc[nH]c3=O)c2)c1	ZINC000740075869	600891292	/nfs/dbraw/zinc/89/12/92/600891292.db2.gz	QFEGJLHCIYFCMJ-UHFFFAOYSA-N	-2	1	393.808	2.730	20	0		GFADML
O=C([O-])c1ccsc1N1CC[C@@H](NC(=O)c2cc3ccccc3cc2[O-])C1=O	ZINC000833131127	601075523	/nfs/dbraw/zinc/07/55/23/601075523.db2.gz	OFCWMRQLBQSJIF-OAHLLOKOSA-N	-2	1	396.424	2.840	20	0		GFADML
C[C@H](NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)[C@@H](C)c1ccccc1	ZINC000827695263	601184723	/nfs/dbraw/zinc/18/47/23/601184723.db2.gz	PYRHDSIIRKAQIB-CABCVRRESA-N	-2	1	393.443	2.715	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3ccc(C=CC(=O)[O-])cc3)c2)n[nH]1	ZINC000832990493	601205751	/nfs/dbraw/zinc/20/57/51/601205751.db2.gz	DBMZRJSATZNLCJ-POHAHGRESA-N	-2	1	398.444	2.987	20	0		GFADML
CC(C)Oc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(F)cc(C(=O)[O-])c1	ZINC000443367423	601224067	/nfs/dbraw/zinc/22/40/67/601224067.db2.gz	VZDLRPDBWPMSFF-UHFFFAOYSA-N	-2	1	397.380	2.810	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)ccc1F	ZINC000747609229	601333101	/nfs/dbraw/zinc/33/31/01/601333101.db2.gz	PKSKLJMLLVRIKW-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2cc(F)ccc2[O-])CC1	ZINC000833171079	601387083	/nfs/dbraw/zinc/38/70/83/601387083.db2.gz	MGSZFTLHQYFRDA-QGZVFWFLSA-N	-2	1	392.814	2.768	20	0		GFADML
O=C([O-])c1sc2ccccc2c1S(=O)(=O)Nc1ccc(C(=O)[O-])c(O)c1	ZINC000833320913	601388181	/nfs/dbraw/zinc/38/81/81/601388181.db2.gz	ZOCGELWKBNDFIA-UHFFFAOYSA-N	-2	1	393.398	2.804	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1	ZINC000751142754	601484502	/nfs/dbraw/zinc/48/45/02/601484502.db2.gz	MUUDQWNXKFUTOW-UHFFFAOYSA-N	-2	1	399.371	2.569	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)N[C@H](c1ccccc1)[C@@H](C)C(=O)[O-]	ZINC000833003989	601608524	/nfs/dbraw/zinc/60/85/24/601608524.db2.gz	DWNQMBLVFVJQPW-ODXCJYRJSA-N	-2	1	396.447	2.563	20	0		GFADML
COC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000831198337	601859842	/nfs/dbraw/zinc/85/98/42/601859842.db2.gz	HHVVKLVPOXGGQO-UHFFFAOYSA-N	-2	1	382.369	2.527	20	0		GFADML
Cc1ccc(NC(=O)[C@@H](C)CC(=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1	ZINC000832942060	602096660	/nfs/dbraw/zinc/09/66/60/602096660.db2.gz	AKTAXLLOGZTWPL-ZDUSSCGKSA-N	-2	1	376.434	2.845	20	0		GFADML
O=C([O-])NCCOc1cccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)c1	ZINC000740668156	602447906	/nfs/dbraw/zinc/44/79/06/602447906.db2.gz	PLHJEBPSVHYOJB-UHFFFAOYSA-N	-2	1	388.804	2.926	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CN(C(=O)[O-])CC3)cc1C(=O)[O-]	ZINC000740147983	602491099	/nfs/dbraw/zinc/49/10/99/602491099.db2.gz	RRAZCXBPUPAPAY-UHFFFAOYSA-N	-3	1	390.417	2.530	20	0		GFADML
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3ccccc3NC(=O)[O-])cc2C[C@H]1C	ZINC000738540102	602651886	/nfs/dbraw/zinc/65/18/86/602651886.db2.gz	MUYFBLIPVOFWPJ-LLVKDONJSA-N	-2	1	389.433	2.875	20	0		GFADML
CN(CC(=O)Nc1cccc(Cl)c1)C(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000739628477	602846816	/nfs/dbraw/zinc/84/68/16/602846816.db2.gz	YZCZZCJWVNLTNK-UHFFFAOYSA-N	-2	1	377.784	2.846	20	0		GFADML
CC(C)NC(=O)Nc1ccc(CNC(=O)c2ccc(NC(=O)[O-])cc2[O-])cc1	ZINC000738857701	602847982	/nfs/dbraw/zinc/84/79/82/602847982.db2.gz	TYGMFDCSDQRESK-UHFFFAOYSA-N	-2	1	386.408	2.942	20	0		GFADML
CSc1nc(C)c(CCC(=O)O[C@H]2CCCC[C@@H]2CNC(=O)[O-])c(=O)[n-]1	ZINC000829777742	603465999	/nfs/dbraw/zinc/46/59/99/603465999.db2.gz	MCFQXQCKWQBELT-YPMHNXCESA-N	-2	1	383.470	2.515	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])cc2)cc(F)c1F	ZINC000828760721	603495864	/nfs/dbraw/zinc/49/58/64/603495864.db2.gz	HTHBMPJDSNBDKI-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
CN(C(=O)OC(C)(C)C)[C@@H]1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000827927534	603608390	/nfs/dbraw/zinc/60/83/90/603608390.db2.gz	RKAZSHNHGLJKDZ-GFCCVEGCSA-N	-2	1	379.413	2.564	20	0		GFADML
CSc1nc(C)c(CCC(=O)O[C@H](C)[C@@H]2CCCCN2C(=O)[O-])c(=O)[n-]1	ZINC000829777717	604120138	/nfs/dbraw/zinc/12/01/38/604120138.db2.gz	LEMKXNHXFGBYSW-YPMHNXCESA-N	-2	1	383.470	2.609	20	0		GFADML
O=C([O-])Cc1cccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)c1	ZINC000767740023	604631954	/nfs/dbraw/zinc/63/19/54/604631954.db2.gz	VIOKMUZYJYBARY-UHFFFAOYSA-N	-3	1	387.772	2.605	20	0		GFADML
O=C([O-])[C@H](NC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-])C1CC1	ZINC000833768885	604721934	/nfs/dbraw/zinc/72/19/34/604721934.db2.gz	QKYCPFMMVBNGBR-MRXNPFEDSA-N	-2	1	390.342	2.516	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1n[nH]c(-c2ccc(C)o2)c1C	ZINC000433601175	604808662	/nfs/dbraw/zinc/80/86/62/604808662.db2.gz	WPYDMIRWJZOBFX-UHFFFAOYSA-N	-2	1	391.405	2.794	20	0		GFADML
CCC[C@@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)cc2)cc1)C(=O)[O-]	ZINC000262129349	605022483	/nfs/dbraw/zinc/02/24/83/605022483.db2.gz	KFSMILAYPYYAQW-QGZVFWFLSA-N	-2	1	390.461	2.779	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc3c(c2)CCCN3C(=O)[O-])c1	ZINC000829217454	605237418	/nfs/dbraw/zinc/23/74/18/605237418.db2.gz	RMSPVPWMUOXOSK-UHFFFAOYSA-N	-2	1	392.433	2.935	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(OC)c(OC)cc2C(=O)[O-])c(C)c1F	ZINC000547871249	605262530	/nfs/dbraw/zinc/26/25/30/605262530.db2.gz	NCRFJVCEDKRXBG-UHFFFAOYSA-N	-2	1	399.396	2.659	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@H](CO)c2ccc(C(F)(F)F)cc2)c([O-])c1	ZINC000834254939	605715044	/nfs/dbraw/zinc/71/50/44/605715044.db2.gz	FOAJZGBFXJLCNM-CYBMUJFWSA-N	-2	1	384.310	2.964	20	0		GFADML
CC(C)[C@H](C(=O)[O-])[C@@H](C)[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000819089369	660246224	/nfs/dbraw/zinc/24/62/24/660246224.db2.gz	OHXKNZHIAVPSRJ-XCBNKYQSSA-N	-2	1	399.694	2.521	20	0		GFADML
C[C@H](CC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000037413137	654614882	/nfs/dbraw/zinc/61/48/82/654614882.db2.gz	XTQCLVWFKHHBLW-RXMQYKEDSA-N	-2	1	391.070	2.897	20	0		GFADML
Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(C(N)=O)c(Cl)c2)cc1C(=O)[O-]	ZINC000042796882	654645129	/nfs/dbraw/zinc/64/51/29/654645129.db2.gz	KVSUGIDEULSIGO-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
CS(=O)(=O)[N-]c1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1F	ZINC000055586721	654778944	/nfs/dbraw/zinc/77/89/44/654778944.db2.gz	AJIBHNSWNRCXMF-UHFFFAOYSA-N	-2	1	378.834	2.651	20	0		GFADML
O=C([O-])[C@H]1C=C[C@H]([N-]S(=O)(=O)c2c(Cl)cc(F)cc2Br)C1	ZINC000275040060	655213357	/nfs/dbraw/zinc/21/33/57/655213357.db2.gz	QYSVJSFNEKBBHR-XPUUQOCRSA-N	-2	1	398.637	2.549	20	0		GFADML
O=C([O-])[C@@H](CC(F)F)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000275341151	655230562	/nfs/dbraw/zinc/23/05/62/655230562.db2.gz	VEOUAQOEILNIJK-SSDOTTSWSA-N	-2	1	381.706	2.746	20	0		GFADML
O=C([O-])c1cc(F)c(F)c(S(=O)(=O)[N-]Cc2nc3ccccc3s2)c1	ZINC000184879925	655360135	/nfs/dbraw/zinc/36/01/35/655360135.db2.gz	BFNDIUZVUXVYAA-UHFFFAOYSA-N	-2	1	384.385	2.751	20	0		GFADML
O=C([N-][N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl)NC1CCCCC1	ZINC000190192613	655390323	/nfs/dbraw/zinc/39/03/23/655390323.db2.gz	OXRREJUEASSFMP-UHFFFAOYSA-N	-2	1	384.260	2.958	20	0		GFADML
C[C@@H]1CSCCN1C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000265659117	655488457	/nfs/dbraw/zinc/48/84/57/655488457.db2.gz	AOHUDJIAHPJARV-LLVKDONJSA-N	-2	1	398.531	2.832	20	0		GFADML
COC(=O)c1cccc(Cl)c1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1F	ZINC000579100006	655493895	/nfs/dbraw/zinc/49/38/95/655493895.db2.gz	OUVCYDVESJPYJL-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])C[C@H](Cc1ccccc1)[N-]S(=O)(=O)c1c(Cl)ccnc1Cl	ZINC000776609880	656765659	/nfs/dbraw/zinc/76/56/59/656765659.db2.gz	CNDZHIGMWUMXQV-NSHDSACASA-N	-2	1	389.260	2.753	20	0		GFADML
O=C([O-])[C@@H](CC1CC1)[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000806640825	659838814	/nfs/dbraw/zinc/83/88/14/659838814.db2.gz	ZBGUCIKUUKZWJO-ZCFIWIBFSA-N	-2	1	388.692	2.696	20	0		GFADML
C[C@@H]1CC[C@H](C(=O)[O-])C[C@@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000871771916	662733239	/nfs/dbraw/zinc/73/32/39/662733239.db2.gz	TVOIBXTYDDKKRR-WEDXCCLWSA-N	-2	1	382.301	2.678	20	0		GFADML
O=C([O-])C[C@H]1COCC[C@@H]1[N-]S(=O)(=O)c1sc2ccccc2c1Cl	ZINC000899948691	663703649	/nfs/dbraw/zinc/70/36/49/663703649.db2.gz	FPJRZWTXKPFNGQ-ONGXEEELSA-N	-2	1	389.882	2.713	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)[N-][C@@H]2CCSC3(CC(C(=O)[O-])C3)C2)c(F)c1	ZINC000899950184	663703957	/nfs/dbraw/zinc/70/39/57/663703957.db2.gz	XDMWMSZAMKTHAO-NOEPWBJOSA-N	-2	1	391.461	2.681	20	0		GFADML
COc1ccc(Br)c(S(=O)(=O)[N-]CCCCCC(=O)[O-])c1F	ZINC000905182460	663857127	/nfs/dbraw/zinc/85/71/27/663857127.db2.gz	IEUVWUKNQHOODL-UHFFFAOYSA-N	-2	1	398.250	2.520	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc1Cl	ZINC000055677380	551174378	/nfs/dbraw/zinc/17/43/78/551174378.db2.gz	GSSCXDFDYSCHFR-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)C(=O)[O-]	ZINC000262573895	553172381	/nfs/dbraw/zinc/17/23/81/553172381.db2.gz	ZQRGOMBMEJURQP-JTQLQIEISA-N	-2	1	388.642	2.629	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000393103837	563528687	/nfs/dbraw/zinc/52/86/87/563528687.db2.gz	DLHRYJSAYOOUTE-UHFFFAOYSA-N	-2	1	382.825	2.589	20	0		GFADML
COc1ccc(NC(=O)c2cc(F)cc(Cl)c2[O-])cc1[N-]S(C)(=O)=O	ZINC000436936724	563685765	/nfs/dbraw/zinc/68/57/65/563685765.db2.gz	ZKQIVSFLBUFPAM-UHFFFAOYSA-N	-2	1	388.804	2.817	20	0		GFADML
COC[C@H](C)n1ccc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2[O-])n1	ZINC000451033249	564265734	/nfs/dbraw/zinc/26/57/34/564265734.db2.gz	SPLGNDHXRYPUGT-VIFPVBQESA-N	-2	1	379.360	2.616	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2C(=O)[O-])c(C)c1F	ZINC000542092308	564301559	/nfs/dbraw/zinc/30/15/59/564301559.db2.gz	FVPLGWNGUBFQGJ-UHFFFAOYSA-N	-2	1	375.324	2.920	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2c(C)ccc(Cl)c2C(=O)[O-])cc1C(N)=O	ZINC000475744780	564317608	/nfs/dbraw/zinc/31/76/08/564317608.db2.gz	CDBNISGVNBTXNW-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc([S@@](C)=O)c1	ZINC000476394838	564337756	/nfs/dbraw/zinc/33/77/56/564337756.db2.gz	CTAGVVRPHOCFNW-HSZRJFAPSA-N	-2	1	387.866	2.885	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc3c(c2)CC(=O)N3)cc1C(=O)[O-]	ZINC000479231601	564432786	/nfs/dbraw/zinc/43/27/86/564432786.db2.gz	JGQNGTGYRRISIZ-UHFFFAOYSA-N	-2	1	380.809	2.642	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(Br)cn2)c(Cl)c1	ZINC000547578409	564497603	/nfs/dbraw/zinc/49/76/03/564497603.db2.gz	MHBFXSBKAZXHBV-UHFFFAOYSA-N	-2	1	391.630	2.997	20	0		GFADML
CCC[C@H](O)[C@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)[O-]	ZINC000547613300	564503466	/nfs/dbraw/zinc/50/34/66/564503466.db2.gz	SZIGONFCQZQMAM-UWVGGRQHSA-N	-2	1	390.672	2.539	20	0		GFADML
O=C([O-])CC1(C[N-]S(=O)(=O)c2ccc(Br)o2)CCCCC1	ZINC000547923721	564522099	/nfs/dbraw/zinc/52/20/99/564522099.db2.gz	FCFRKWLDRLNSCC-UHFFFAOYSA-N	-2	1	380.260	2.746	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1ccc(Cl)c(F)c1	ZINC000548260940	564544313	/nfs/dbraw/zinc/54/43/13/564544313.db2.gz	YAEFCPIQFJQDTN-GFCCVEGCSA-N	-2	1	379.743	2.862	20	0		GFADML
CC(C)(C)[C@@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000548531443	564556639	/nfs/dbraw/zinc/55/66/39/564556639.db2.gz	QVMSGVORTVPDDB-JTQLQIEISA-N	-2	1	386.214	2.505	20	0		GFADML
O=C([O-])c1c(Cl)cccc1[N-]S(=O)(=O)c1ccc2[nH]c(=O)ccc2c1	ZINC000484481262	564589349	/nfs/dbraw/zinc/58/93/49/564589349.db2.gz	UFBUNXIMHDISJW-UHFFFAOYSA-N	-2	1	378.793	2.681	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)ccc1F	ZINC000522961323	564660132	/nfs/dbraw/zinc/66/01/32/564660132.db2.gz	OVGRSMLLOOKTTE-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]C[C@@H](CCC(=O)[O-])C(F)(F)F)c(F)cc1F	ZINC000663293136	565407997	/nfs/dbraw/zinc/40/79/97/565407997.db2.gz	BAICQOWDNXXQMZ-MRVPVSSYSA-N	-2	1	375.315	2.595	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CCC[C@@H]2C[C@@H]21	ZINC000672135086	565795696	/nfs/dbraw/zinc/79/56/96/565795696.db2.gz	SAZDAANSILDRRP-RISCZKNCSA-N	-2	1	378.475	2.879	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1cc(Cl)c(Cl)cc1Br)C(=O)[O-]	ZINC000656509247	566129318	/nfs/dbraw/zinc/12/93/18/566129318.db2.gz	PGUOOIWQUPMQBB-MRVPVSSYSA-N	-2	1	391.070	2.897	20	0		GFADML
CN(C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)cc1)C(C)(C)C(=O)[O-]	ZINC000737338465	599848075	/nfs/dbraw/zinc/84/80/75/599848075.db2.gz	CALVCLOPUOZDFF-UHFFFAOYSA-N	-2	1	394.424	2.562	20	0		GFADML
CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NCC(=O)[O-])cc2)cc1	ZINC000013360047	599874799	/nfs/dbraw/zinc/87/47/99/599874799.db2.gz	AGRBXMJMGCEDPK-ZDUSSCGKSA-N	-2	1	390.461	2.815	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1ccc(C)c(S(=O)(=O)[N-]c2cccc(C)c2)c1	ZINC000262385423	600024961	/nfs/dbraw/zinc/02/49/61/600024961.db2.gz	HQWOIIKWCKKHKJ-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCCCc4ccccc43)cc2)[n-]1	ZINC000739876727	600025660	/nfs/dbraw/zinc/02/56/60/600025660.db2.gz	HJJMFWKJGXRBGX-UHFFFAOYSA-N	-2	1	391.427	2.776	20	0		GFADML
COC(=O)Nc1cc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])ccc1F	ZINC000737641559	600099108	/nfs/dbraw/zinc/09/91/08/600099108.db2.gz	GUMGOJWNPUSUQX-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
O=C([O-])[C@H]1C[C@@H]1C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1	ZINC000485468876	600102091	/nfs/dbraw/zinc/10/20/91/600102091.db2.gz	VILMLPAYAJGVRZ-GJZGRUSLSA-N	-2	1	394.836	2.800	20	0		GFADML
O=C([O-])c1ccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)cc1Cl	ZINC000740090174	600234366	/nfs/dbraw/zinc/23/43/66/600234366.db2.gz	WEKWWTOQVQDETM-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2cnn(Cc3ccccc3)c2)c(F)c1	ZINC000484577164	600235994	/nfs/dbraw/zinc/23/59/94/600235994.db2.gz	SWMUBBPNZGSJJL-UHFFFAOYSA-N	-2	1	375.381	2.570	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)ccc1F	ZINC000736160791	600255428	/nfs/dbraw/zinc/25/54/28/600255428.db2.gz	INQGOICONJNFAO-UHFFFAOYSA-N	-2	1	380.397	2.602	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])cc1Br	ZINC000738040865	600488154	/nfs/dbraw/zinc/48/81/54/600488154.db2.gz	CNSKERJDVZQVDB-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COc1ccccc1-n1cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2F)cn1	ZINC000484528358	600673054	/nfs/dbraw/zinc/67/30/54/600673054.db2.gz	IZOJXNZLMZSJTB-UHFFFAOYSA-N	-2	1	391.380	2.519	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(-c3nnc(C)o3)cc2)cc1C(=O)[O-]	ZINC000738064050	600679100	/nfs/dbraw/zinc/67/91/00/600679100.db2.gz	PULGNVNUEXOZSY-UHFFFAOYSA-N	-2	1	389.389	2.553	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(N3CCOC3=O)cc2)cc1Cl	ZINC000740155051	600694614	/nfs/dbraw/zinc/69/46/14/600694614.db2.gz	LMHRYYZHWRJZRQ-UHFFFAOYSA-N	-2	1	396.808	2.796	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2ccc3c(c2)OC2(CCCCC2)O3)cc1C(=O)[O-]	ZINC000641951109	600809142	/nfs/dbraw/zinc/80/91/42/600809142.db2.gz	AOTQRKQWDLWLDZ-UHFFFAOYSA-N	-2	1	392.433	2.956	20	0		GFADML
COc1ccc(Cl)c(C(=O)[O-])c1NS(=O)(=O)c1ccc(C)c(C(=O)[O-])c1	ZINC000505128986	600814027	/nfs/dbraw/zinc/81/40/27/600814027.db2.gz	MWIHMGLWBZZHOY-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)N3CCCC3)cc2)ccc1C(=O)[O-]	ZINC000285226209	600887529	/nfs/dbraw/zinc/88/75/29/600887529.db2.gz	VDUBSCSXEUFKPH-UHFFFAOYSA-N	-2	1	388.445	2.730	20	0		GFADML
Cn1cnnc1-c1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000739056598	600889564	/nfs/dbraw/zinc/88/95/64/600889564.db2.gz	GENSMUPKXHCOII-UHFFFAOYSA-N	-2	1	392.824	2.635	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2cc(F)c(F)cc2C(=O)[O-])c1	ZINC000740075295	600892566	/nfs/dbraw/zinc/89/25/66/600892566.db2.gz	IMDKMAHYSWKRJQ-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
CCC[C@]1(C)CCCN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000829238591	600968458	/nfs/dbraw/zinc/96/84/58/600968458.db2.gz	XLLYMULDVRHDPQ-OAQYLSRUSA-N	-2	1	385.464	2.835	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2cc(C)c(F)c(C)c2)c(C(=O)[O-])cc1OC	ZINC000460451538	601045553	/nfs/dbraw/zinc/04/55/53/601045553.db2.gz	QAKNGLBYVSBZCD-UHFFFAOYSA-N	-2	1	383.397	2.959	20	0		GFADML
C[C@@H]1c2ccccc2CN1C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000828528514	601084672	/nfs/dbraw/zinc/08/46/72/601084672.db2.gz	WGHLLFAUVVHTCL-CYBMUJFWSA-N	-2	1	377.400	2.510	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000476249116	601320210	/nfs/dbraw/zinc/32/02/10/601320210.db2.gz	BRXQPUUCSCYOCR-UHFFFAOYSA-N	-2	1	381.381	2.728	20	0		GFADML
COC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000831210472	601324978	/nfs/dbraw/zinc/32/49/78/601324978.db2.gz	QJHPFURSFQUMLZ-UHFFFAOYSA-N	-2	1	378.406	2.981	20	0		GFADML
COC(=O)/C=C/c1ccc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])cc1	ZINC000747607722	601330471	/nfs/dbraw/zinc/33/04/71/601330471.db2.gz	BYSSGOQALYXNPR-JXMROGBWSA-N	-2	1	379.365	2.511	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)ccc1C	ZINC000831327720	601334330	/nfs/dbraw/zinc/33/43/30/601334330.db2.gz	MEZQRGDRFWFGSM-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC(=O)N1CCc2cc(S(=O)(=O)[N-]c3cc(Cl)ccc3C(=O)[O-])ccc21	ZINC000013309799	601357092	/nfs/dbraw/zinc/35/70/92/601357092.db2.gz	WBNLSSYPLUSOBL-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
O=C([O-])[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2cc(F)ccc2[O-])CC1	ZINC000833171078	601387189	/nfs/dbraw/zinc/38/71/89/601387189.db2.gz	MGSZFTLHQYFRDA-KRWDZBQOSA-N	-2	1	392.814	2.768	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(O[C@@H]3CCOC3)cc2)cc(F)c1F	ZINC000751143932	601484499	/nfs/dbraw/zinc/48/44/99/601484499.db2.gz	YVIYPNCFAKJMDQ-GFCCVEGCSA-N	-2	1	399.371	2.632	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)N[C@@H](c1ccccc1)[C@H](C)C(=O)[O-]	ZINC000833003987	601608516	/nfs/dbraw/zinc/60/85/16/601608516.db2.gz	DWNQMBLVFVJQPW-FKIZINRSSA-N	-2	1	396.447	2.563	20	0		GFADML
CC[C@@H](NC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(F)cc2)c1)C(=O)[O-]	ZINC000581465027	601761308	/nfs/dbraw/zinc/76/13/08/601761308.db2.gz	JBHBFUFUDUTSQT-OAHLLOKOSA-N	-2	1	394.424	2.528	20	0		GFADML
COC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1	ZINC000751145256	601836366	/nfs/dbraw/zinc/83/63/66/601836366.db2.gz	JBAJHEBFLFOTSO-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(-c2csnn2)cc1	ZINC000833293861	601860688	/nfs/dbraw/zinc/86/06/88/601860688.db2.gz	BMLAMLWSHKQTAB-UHFFFAOYSA-N	-2	1	379.394	2.843	20	0		GFADML
CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2cc(C(=O)OC)ccc2C(=O)[O-])[nH]n1	ZINC000829216034	601862020	/nfs/dbraw/zinc/86/20/20/601862020.db2.gz	IPGSMHZKFXJVDH-SNVBAGLBSA-N	-2	1	395.437	2.599	20	0		GFADML
COC(=O)Cc1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])c1	ZINC000831188766	601988096	/nfs/dbraw/zinc/98/80/96/601988096.db2.gz	HWWCKPCYNHLEBN-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
Cc1nc(C)n(-c2ccccc2[N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)n1	ZINC000763305714	601989104	/nfs/dbraw/zinc/98/91/04/601989104.db2.gz	YDBIMNASBMZCAX-UHFFFAOYSA-N	-2	1	390.396	2.522	20	0		GFADML
C[C@H](CC(=O)[O-])C(=O)N(C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000827248378	602144502	/nfs/dbraw/zinc/14/45/02/602144502.db2.gz	ZDOCLDVNGXSCGO-CQSZACIVSA-N	-2	1	390.461	2.557	20	0		GFADML
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])cc1	ZINC000739479609	602244927	/nfs/dbraw/zinc/24/49/27/602244927.db2.gz	SKOXLBCLFPWQMI-UHFFFAOYSA-N	-2	1	390.417	2.705	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)OCCNC(=O)[O-])c2)cc1	ZINC000832952977	602257765	/nfs/dbraw/zinc/25/77/65/602257765.db2.gz	PKKKXEJKPOLGSR-UHFFFAOYSA-N	-2	1	392.433	2.529	20	0		GFADML
CCOc1cc(-c2noc(CCCNC(=O)[O-])n2)cc(Br)c1[O-]	ZINC000737179935	602405942	/nfs/dbraw/zinc/40/59/42/602405942.db2.gz	WRYMLJCKUXCUBV-UHFFFAOYSA-N	-2	1	386.202	2.804	20	0		GFADML
CCN(Cc1ccccc1[N-]S(=O)(=O)c1cccc(C(=O)OC)c1)C(=O)[O-]	ZINC000739444665	602655267	/nfs/dbraw/zinc/65/52/67/602655267.db2.gz	MCGHAMSCVAUKHR-UHFFFAOYSA-N	-2	1	392.433	2.774	20	0		GFADML
CC(C)[C@H](CNC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1[O-])NC(=O)[O-]	ZINC000738792846	602864701	/nfs/dbraw/zinc/86/47/01/602864701.db2.gz	ZNTWBGVRFUGTLL-ZDUSSCGKSA-N	-2	1	381.429	2.761	20	0		GFADML
CCc1cc2c(COC(=O)[C@@H]3CCC[C@H]3NC(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000739542639	603127808	/nfs/dbraw/zinc/12/78/08/603127808.db2.gz	LGTZGMMJLYJMND-TZMCWYRMSA-N	-2	1	375.377	2.541	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)cc1OC	ZINC000829511173	603402924	/nfs/dbraw/zinc/40/29/24/603402924.db2.gz	VAGREMKMYRSAFD-NSHDSACASA-N	-2	1	380.422	2.833	20	0		GFADML
CCN(CC(=O)Nc1ccc(C)c([N-]S(=O)(=O)c2ccccc2)c1)C(=O)[O-]	ZINC000739396502	603424228	/nfs/dbraw/zinc/42/42/28/603424228.db2.gz	ZYQFMOPPMZPRQK-UHFFFAOYSA-N	-2	1	391.449	2.734	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC[C@@H]([C@@H]2CCCN2C(=O)[O-])C1	ZINC000830705160	603481419	/nfs/dbraw/zinc/48/14/19/603481419.db2.gz	XMORWJHJKUEFJB-KGLIPLIRSA-N	-2	1	390.484	2.783	20	0		GFADML
C[C@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000825449660	604200330	/nfs/dbraw/zinc/20/03/30/604200330.db2.gz	WBUZDGWHUYKBNZ-VIFPVBQESA-N	-3	1	382.369	2.653	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ccc(F)cc1C(=O)[O-])c1nc(C2CCCCC2)no1	ZINC000833522609	604689372	/nfs/dbraw/zinc/68/93/72/604689372.db2.gz	CQRJERSRYMQWOL-SNVBAGLBSA-N	-2	1	397.428	2.994	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1S(=O)(=O)[N-]c1ncccc1Br	ZINC000833318332	604798890	/nfs/dbraw/zinc/79/88/90/604798890.db2.gz	YKKMAJKVSBSBGM-UHFFFAOYSA-N	-2	1	391.630	2.997	20	0		GFADML
Cc1nc(C2([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])CCCCCC2)no1	ZINC000833755275	605017800	/nfs/dbraw/zinc/01/78/00/605017800.db2.gz	HRVGNDDDANIFBA-UHFFFAOYSA-N	-2	1	397.428	2.743	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(F)cc(C(=O)[O-])c1	ZINC000443351600	605162957	/nfs/dbraw/zinc/16/29/57/605162957.db2.gz	AEWOHYVJNYGIJD-UHFFFAOYSA-N	-2	1	397.380	2.812	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])c(OC)c2)c1	ZINC000829217020	605236359	/nfs/dbraw/zinc/23/63/59/605236359.db2.gz	HLICTLQERAROKG-UHFFFAOYSA-N	-2	1	382.394	2.603	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])c1	ZINC000829217211	605237523	/nfs/dbraw/zinc/23/75/23/605237523.db2.gz	KPSONYNOWGVPRV-UHFFFAOYSA-N	-2	1	378.406	2.545	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)c1	ZINC000829217269	605237628	/nfs/dbraw/zinc/23/76/28/605237628.db2.gz	MOTYWSLDFTVOLW-LLVKDONJSA-N	-2	1	380.422	2.833	20	0		GFADML
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000833863557	605654289	/nfs/dbraw/zinc/65/42/89/605654289.db2.gz	WNWMRSXTVKAWCB-UHFFFAOYSA-N	-2	1	387.392	2.835	20	0		GFADML
CC(C)(C)n1cc(-c2nn[n-]n2)c([N-]S(=O)(=O)c2cccc3ccccc32)n1	ZINC000819972061	606708525	/nfs/dbraw/zinc/70/85/25/606708525.db2.gz	ZJEWUXQAOAASEN-UHFFFAOYSA-N	-2	1	397.464	2.772	20	0		GFADML
CNC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2cc(C)c(C(=O)[O-])s2)c1	ZINC000042794301	654644752	/nfs/dbraw/zinc/64/47/52/654644752.db2.gz	QBZXZXSRMSIHPO-UHFFFAOYSA-N	-2	1	388.854	2.569	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)ccc1Cl	ZINC000044330491	654656430	/nfs/dbraw/zinc/65/64/30/654656430.db2.gz	JSTQTCFOFASWNH-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC(C)(C)c1ccc(S(=O)(=O)[N-]NC(=O)c2ccc(Cl)cc2[O-])cc1	ZINC000055665152	654780219	/nfs/dbraw/zinc/78/02/19/654780219.db2.gz	MEZVOPXBQMSVDV-UHFFFAOYSA-N	-2	1	382.869	2.966	20	0		GFADML
COC(=O)C1(CS(=O)(=O)[N-]c2ccc(Br)cc2[O-])CCCC1	ZINC000578688373	655484692	/nfs/dbraw/zinc/48/46/92/655484692.db2.gz	VGTHLFUXRKSMSL-UHFFFAOYSA-N	-2	1	392.271	2.630	20	0		GFADML
CC(F)(F)CCC[N-]S(=O)(=O)c1sc(C(=O)[O-])cc1Br	ZINC000840892141	661200414	/nfs/dbraw/zinc/20/04/14/661200414.db2.gz	VQTZESPSZSGFTE-UHFFFAOYSA-N	-2	1	392.243	2.923	20	0		GFADML
C[C@]1(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CC1(Cl)Cl	ZINC000840894798	661201696	/nfs/dbraw/zinc/20/16/96/661201696.db2.gz	VMFYVRINMLKNJT-LBPRGKRZSA-N	-2	1	388.219	2.915	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc(C[S@@](C)=O)c2)cc(C(=O)[O-])c1F	ZINC000763287111	656078490	/nfs/dbraw/zinc/07/84/90/656078490.db2.gz	NEYXORUMVHDTMY-XMMPIXPASA-N	-2	1	385.438	2.512	20	0		GFADML
O=C([O-])c1cc(F)cc([N-]S(=O)(=O)c2c(Cl)nc3ccccn32)c1F	ZINC000776561671	656757926	/nfs/dbraw/zinc/75/79/26/656757926.db2.gz	POLSLGBEKDEDER-UHFFFAOYSA-N	-2	1	387.751	2.765	20	0		GFADML
O=C([O-])[C@H](CC1CCOCC1)[N-]S(=O)(=O)c1cc(Cl)sc1Cl	ZINC000776600480	656764995	/nfs/dbraw/zinc/76/49/95/656764995.db2.gz	MEYDNZBYJDXKAS-QMMMGPOBSA-N	-2	1	388.294	2.603	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc(N3CCC3=O)c2)cc1Cl	ZINC000790350942	657957420	/nfs/dbraw/zinc/95/74/20/657957420.db2.gz	OJVTVLYILVCCDP-UHFFFAOYSA-N	-2	1	380.809	2.576	20	0		GFADML
CCC[C@H](C(=O)OCC)S(=O)(=O)[N-]c1ccc(Br)cc1[O-]	ZINC000844654898	661432054	/nfs/dbraw/zinc/43/20/54/661432054.db2.gz	LYUVKEYBVBEPKE-GFCCVEGCSA-N	-2	1	380.260	2.628	20	0		GFADML
COc1cc(Cl)c(S(=O)(=O)[N-][C@@H](C2CC2)C(F)(F)F)cc1C(=O)[O-]	ZINC000871964391	662747185	/nfs/dbraw/zinc/74/71/85/662747185.db2.gz	XMGHTMDBOGYRAR-NSHDSACASA-N	-2	1	387.763	2.666	20	0		GFADML
Cc1csc([C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)C2CC2)n1	ZINC000185064686	552353003	/nfs/dbraw/zinc/35/30/03/552353003.db2.gz	VBXIPDSQKKZKSN-CYBMUJFWSA-N	-2	1	388.417	2.858	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)[C@@H]1CCOC2(CCC2)C1	ZINC000372262907	563300609	/nfs/dbraw/zinc/30/06/09/563300609.db2.gz	TWCLRHBIHIONSJ-MFKMUULPSA-N	-2	1	391.848	2.560	20	0		GFADML
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000327692581	563459146	/nfs/dbraw/zinc/45/91/46/563459146.db2.gz	TUBLNKDJOLEWFQ-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(C(F)(F)F)c2)cs1	ZINC000431183976	563556572	/nfs/dbraw/zinc/55/65/72/563556572.db2.gz	SIUQXZJFJYHWPN-UHFFFAOYSA-N	-2	1	395.336	2.964	20	0		GFADML
C[C@H]1CSC[C@H]1NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436623235	563675218	/nfs/dbraw/zinc/67/52/18/563675218.db2.gz	GCCXGGXFIXZOPV-GXFFZTMASA-N	-2	1	398.531	2.736	20	0		GFADML
COC(=O)Cc1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])c1	ZINC000563261585	564183108	/nfs/dbraw/zinc/18/31/08/564183108.db2.gz	FVIGFCHTDQZQRM-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2cc(C)cc(C(=O)[O-])c2)c1	ZINC000507567248	564232612	/nfs/dbraw/zinc/23/26/12/564232612.db2.gz	PNIKESSGBQQAAC-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CC(C)[C@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000564841061	564251760	/nfs/dbraw/zinc/25/17/60/564251760.db2.gz	YFNSJIKYPLTDLN-LURJTMIESA-N	-2	1	390.708	2.942	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(NC(N)=O)cc1	ZINC000476292623	564333288	/nfs/dbraw/zinc/33/32/88/564333288.db2.gz	ZJJVDRWVSCOPOZ-UHFFFAOYSA-N	-2	1	383.813	2.638	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(CC(=O)[O-])cc2)cc1Cl	ZINC000546536218	564458452	/nfs/dbraw/zinc/45/84/52/564458452.db2.gz	RBSIDSSKRIXKES-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
O=C([O-])[C@H](Cc1cccc(Cl)c1)[N-]S(=O)(=O)c1ccc(F)c(F)c1F	ZINC000547931938	564522966	/nfs/dbraw/zinc/52/29/66/564522966.db2.gz	OVVWTPSGTKCORR-NSHDSACASA-N	-2	1	393.770	2.732	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl)C(=O)[O-]	ZINC000548206987	564536963	/nfs/dbraw/zinc/53/69/63/564536963.db2.gz	FKNGPYMGIYSCLH-MRVPVSSYSA-N	-2	1	391.070	2.897	20	0		GFADML
CSc1cccc(S(=O)(=O)[N-]c2cc3c(cc2C(=O)[O-])OCCO3)c1	ZINC000548995563	564583479	/nfs/dbraw/zinc/58/34/79/564583479.db2.gz	WMRLHDWGKBHHGM-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1cc(Cl)ccc1Cl)C(F)(F)F	ZINC000551997541	564672528	/nfs/dbraw/zinc/67/25/28/564672528.db2.gz	NYJWEJWYCDUNAQ-LURJTMIESA-N	-2	1	380.171	2.925	20	0		GFADML
Cc1cc(C(=O)NCc2c(Cl)cccc2Cl)[n-]c2nc(=O)[n-]c(=O)c1-2	ZINC000531052900	564900848	/nfs/dbraw/zinc/90/08/48/564900848.db2.gz	JLHQDXFANXIBMC-UHFFFAOYSA-N	-2	1	379.203	2.981	20	0		GFADML
COc1nc2ccc([N-]S(=O)(=O)c3cccc(CC(=O)[O-])c3)cc2s1	ZINC000558588758	564907888	/nfs/dbraw/zinc/90/78/88/564907888.db2.gz	KAUYWGCJWMBSLY-UHFFFAOYSA-N	-2	1	378.431	2.733	20	0		GFADML
CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2C)cc1Cl	ZINC000466352995	564938465	/nfs/dbraw/zinc/93/84/65/564938465.db2.gz	PRMQCUQCQQYYBO-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
O=C([O-])CC[C@H](C[N-]S(=O)(=O)c1cc(F)ccc1Cl)C(F)(F)F	ZINC000663294503	565409277	/nfs/dbraw/zinc/40/92/77/565409277.db2.gz	SUQBUTXHSYRGSV-SSDOTTSWSA-N	-2	1	377.743	2.801	20	0		GFADML
CC[C@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000654783579	566023013	/nfs/dbraw/zinc/02/30/13/566023013.db2.gz	ZIXJMOUECJAWGS-SSDOTTSWSA-N	-2	1	386.214	2.649	20	0		GFADML
C[C@H]1CCc2[n-]n(-c3ccc(S(=O)(=O)[N-]c4nccs4)cc3)c(=O)c21	ZINC000634616973	566160674	/nfs/dbraw/zinc/16/06/74/566160674.db2.gz	CBGKYMGXDOORPG-HZMBPMFUSA-N	-2	1	376.463	2.693	20	0		GFADML
O=C([O-])c1cccc(CNC(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)c1	ZINC000666565855	598184325	/nfs/dbraw/zinc/18/43/25/598184325.db2.gz	BZBHTQJTMSVAPZ-UHFFFAOYSA-N	-2	1	382.416	2.895	20	0		GFADML
CN(Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1)c1ccc(C(=O)[O-])nn1	ZINC000737486051	599767713	/nfs/dbraw/zinc/76/77/13/599767713.db2.gz	FZUYFTOHVPXMLE-UHFFFAOYSA-N	-2	1	398.444	2.612	20	0		GFADML
O=C([O-])c1cc2c(c(S(=O)(=O)[N-]c3cccc(F)c3C(=O)[O-])c1)CCC2	ZINC000516771942	599851915	/nfs/dbraw/zinc/85/19/15/599851915.db2.gz	JBVWRUYXKYESTI-UHFFFAOYSA-N	-3	1	379.365	2.512	20	0		GFADML
O=C([O-])[C@H](CNC(=O)c1cc(Br)ccc1[O-])Cc1cccc(F)c1	ZINC000739406594	599985080	/nfs/dbraw/zinc/98/50/80/599985080.db2.gz	BPUGADJRIGCMET-NSHDSACASA-N	-2	1	396.212	2.967	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1ccc(S(=O)(=O)[N-]c2cccc(C)c2C)cc1	ZINC000262429458	600025092	/nfs/dbraw/zinc/02/50/92/600025092.db2.gz	OCOZSQODOHOCFF-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
C[C@H](OC(=O)c1ccc(Cl)c(Cl)c1[O-])C(=O)N1CCC(C(=O)[O-])CC1	ZINC000736692550	600109065	/nfs/dbraw/zinc/10/90/65/600109065.db2.gz	WEAOWWGDFBPHAV-QMMMGPOBSA-N	-2	1	390.219	2.568	20	0		GFADML
O=C([O-])CCOc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)cc1	ZINC000739672050	600383707	/nfs/dbraw/zinc/38/37/07/600383707.db2.gz	NRRYFZPYLZIVLV-UHFFFAOYSA-N	-2	1	399.808	2.693	20	0		GFADML
CN(C)C(=O)c1cccc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737360948	600638038	/nfs/dbraw/zinc/63/80/38/600638038.db2.gz	LRKAJFGVESZHRS-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)[O-])ccc1C	ZINC000831348476	600808487	/nfs/dbraw/zinc/80/84/87/600808487.db2.gz	SCAJQWTWSNNCOL-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)n(-c2ccncc2)n1	ZINC000832898502	600988092	/nfs/dbraw/zinc/98/80/92/600988092.db2.gz	NBWBKEMSPIEZPD-UHFFFAOYSA-N	-2	1	392.824	2.728	20	0		GFADML
CCOc1ccc(F)c(C(=O)[O-])c1NS(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000507970206	601116598	/nfs/dbraw/zinc/11/65/98/601116598.db2.gz	ZYBUCSSZJVGNAU-UHFFFAOYSA-N	-2	1	397.380	2.730	20	0		GFADML
O=C([O-])c1ccc(Cl)cc1S(=O)(=O)[N-]c1cc(F)c(C(=O)[O-])c(F)c1	ZINC000740134733	601120943	/nfs/dbraw/zinc/12/09/43/601120943.db2.gz	JWKOAHVBXHDDLL-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
COc1cc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2C)c(Cl)cc1C(=O)[O-]	ZINC000485275843	601224157	/nfs/dbraw/zinc/22/41/57/601224157.db2.gz	SMLIICVFYKHBAN-UHFFFAOYSA-N	-2	1	399.808	2.854	20	0		GFADML
CCC(CC)(CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000828804552	601268113	/nfs/dbraw/zinc/26/81/13/601268113.db2.gz	QHGYCWLSYBIJRK-UHFFFAOYSA-N	-2	1	399.694	2.809	20	0		GFADML
COC(=O)/C=C/c1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2C)cc1	ZINC000747595536	601318369	/nfs/dbraw/zinc/31/83/69/601318369.db2.gz	AVQUIMOJRIDYAS-UXBLZVDNSA-N	-2	1	375.402	2.680	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1	ZINC000831160090	601330434	/nfs/dbraw/zinc/33/04/34/601330434.db2.gz	NGVIUPRSGZLPBB-WUXMJOGZSA-N	-2	1	389.429	2.691	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])o1)c1noc(-c2ccc(Cl)cc2)n1	ZINC000827754384	601404678	/nfs/dbraw/zinc/40/46/78/601404678.db2.gz	KMXLTGPWKYGHSX-MRVPVSSYSA-N	-2	1	397.796	2.721	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000507966949	601575748	/nfs/dbraw/zinc/57/57/48/601575748.db2.gz	NWTVUYCQTARVBU-UHFFFAOYSA-N	-2	1	393.417	2.981	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cc(-c3cccc(Cl)c3)n[nH]2)ccc1O	ZINC000833303978	601605695	/nfs/dbraw/zinc/60/56/95/601605695.db2.gz	CORFAMXCLHWIDF-UHFFFAOYSA-N	-2	1	393.808	2.935	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N(CC3CC3)c3ccccc3)cc2)[n-]1	ZINC000833264972	601755625	/nfs/dbraw/zinc/75/56/25/601755625.db2.gz	NLHPQLQFADINLX-UHFFFAOYSA-N	-2	1	391.427	2.850	20	0		GFADML
CC(C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000826975863	601828895	/nfs/dbraw/zinc/82/88/95/601828895.db2.gz	CUNGAEYEOMIICB-UHFFFAOYSA-N	-2	1	396.852	2.977	20	0		GFADML
CC(C)[C@H]([N-]S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1)c1nc(C2CC2)no1	ZINC000826717807	601838284	/nfs/dbraw/zinc/83/82/84/601838284.db2.gz	WANFBXUDTBBMST-ZDUSSCGKSA-N	-2	1	399.856	2.974	20	0		GFADML
CCC(=O)Nc1ccc(C)c([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])c1	ZINC000828570658	601857140	/nfs/dbraw/zinc/85/71/40/601857140.db2.gz	QIMCKZWUAHPGEB-UHFFFAOYSA-N	-2	1	380.397	2.982	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)OCCCNC(=O)[O-])c2)cc1	ZINC000740139191	602226666	/nfs/dbraw/zinc/22/66/66/602226666.db2.gz	KJXNHGDSPIELRE-UHFFFAOYSA-N	-2	1	392.433	2.610	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])c1	ZINC000739781373	602245693	/nfs/dbraw/zinc/24/56/93/602245693.db2.gz	ANLXLWQDXBZNRU-UHFFFAOYSA-N	-2	1	390.417	2.623	20	0		GFADML
O=C([O-])N1CCCc2cc([N-]S(=O)(=O)c3ccc4[nH]c(=O)oc4c3)ccc21	ZINC000740523852	602646716	/nfs/dbraw/zinc/64/67/16/602646716.db2.gz	NMMWWGYOJFOUJC-UHFFFAOYSA-N	-2	1	389.389	2.765	20	0		GFADML
O=C([O-])Nc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC(=O)N2	ZINC000740715674	602653340	/nfs/dbraw/zinc/65/33/40/602653340.db2.gz	HDZZFXYCUQRWCO-UHFFFAOYSA-N	-2	1	375.406	2.852	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])c1C	ZINC000739790554	602673602	/nfs/dbraw/zinc/67/36/02/602673602.db2.gz	XTAJEPPSSWICFG-UHFFFAOYSA-N	-2	1	390.417	2.623	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)c([O-])c1	ZINC000740697747	602863333	/nfs/dbraw/zinc/86/33/33/602863333.db2.gz	HWXYKBNOHBISBJ-GFCCVEGCSA-N	-2	1	377.347	2.769	20	0		GFADML
CSc1nc(C)c(CCC(=O)O[C@H]2CCCC[C@H]2CNC(=O)[O-])c(=O)[n-]1	ZINC000829777739	603466210	/nfs/dbraw/zinc/46/62/10/603466210.db2.gz	MCFQXQCKWQBELT-AAEUAGOBSA-N	-2	1	383.470	2.515	20	0		GFADML
C[C@H](CN(C)C(=O)[O-])C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000824881148	604095503	/nfs/dbraw/zinc/09/55/03/604095503.db2.gz	URJNSRVMRIBFRM-CYBMUJFWSA-N	-2	1	391.449	2.672	20	0		GFADML
C[C@@H](CN(C)C(=O)[O-])C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000824881149	604095621	/nfs/dbraw/zinc/09/56/21/604095621.db2.gz	URJNSRVMRIBFRM-ZDUSSCGKSA-N	-2	1	391.449	2.672	20	0		GFADML
CSc1nc(=O)[n-]c(C)c1C(=O)NCCN(C(=O)[O-])C1CCCCCC1	ZINC000829777789	604266835	/nfs/dbraw/zinc/26/68/35/604266835.db2.gz	NAOHAZLXFHNCPR-UHFFFAOYSA-N	-2	1	382.486	2.645	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@H](C)c1cc(C)c(C(=O)[O-])o1	ZINC000830136813	604573932	/nfs/dbraw/zinc/57/39/32/604573932.db2.gz	JOHVKJFFIHJLGR-LLVKDONJSA-N	-2	1	381.406	2.966	20	0		GFADML
Cc1cc([C@@H](C)OC(=O)CCc2c(C)nc3cc(=O)[n-]n3c2C)oc1C(=O)[O-]	ZINC000832873025	604577317	/nfs/dbraw/zinc/57/73/17/604577317.db2.gz	YZXNGFHZOPCKEE-GFCCVEGCSA-N	-2	1	387.392	2.888	20	0		GFADML
CCOC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(F)cc2C(=O)[O-])cc1	ZINC000833659103	604745706	/nfs/dbraw/zinc/74/57/06/604745706.db2.gz	SBOGEBIDNAPLDG-UHFFFAOYSA-N	-2	1	396.396	2.917	20	0		GFADML
CC(C)C(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000485304763	605160504	/nfs/dbraw/zinc/16/05/04/605160504.db2.gz	ZYQZQAFZNAGCPS-UHFFFAOYSA-N	-2	1	380.397	2.919	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2cc(F)cc(C(=O)[O-])c2)cc1	ZINC000485279926	605164899	/nfs/dbraw/zinc/16/48/99/605164899.db2.gz	AOJWXPFDFVMSSQ-UHFFFAOYSA-N	-3	1	381.381	2.687	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc(OC)c(NC(=O)[O-])c2)c1	ZINC000829217308	605236405	/nfs/dbraw/zinc/23/64/05/605236405.db2.gz	NEPAOSCTLDRRCM-UHFFFAOYSA-N	-2	1	382.394	2.603	20	0		GFADML
O=C([O-])N1CCC2(C[C@@H]2C(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)CC1	ZINC000834288849	605822371	/nfs/dbraw/zinc/82/23/71/605822371.db2.gz	ZKVSSWMKITVKOP-QGZVFWFLSA-N	-2	1	386.448	2.594	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2ccc3oc(=O)ccc3c2)ccc1Cl	ZINC000047318185	654693144	/nfs/dbraw/zinc/69/31/44/654693144.db2.gz	RRSITGSVNLCGOD-UHFFFAOYSA-N	-2	1	379.777	2.945	20	0		GFADML
O=C([N-][N-]S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NC1CCCC1	ZINC000065833092	654888894	/nfs/dbraw/zinc/88/88/94/654888894.db2.gz	HXPQILGUABKNTI-UHFFFAOYSA-N	-2	1	385.795	2.794	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C[C@@H]1C	ZINC000268199257	654962921	/nfs/dbraw/zinc/96/29/21/654962921.db2.gz	OIBQQNBUBUVLRN-RYUDHWBXSA-N	-2	1	380.491	2.983	20	0		GFADML
CC[C@H](C)[C@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1C(=O)OC)C(=O)[O-]	ZINC000263544976	655452521	/nfs/dbraw/zinc/45/25/21/655452521.db2.gz	GIHKAZLZRPORFD-CPCISQLKSA-N	-2	1	398.264	2.558	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(F)c(C(=O)[O-])c2)cc(C(=O)[O-])c1Cl	ZINC000759094151	655947419	/nfs/dbraw/zinc/94/74/19/655947419.db2.gz	JCOHEVAVJBUJNH-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)Cc1ccccc1	ZINC000776561604	656757903	/nfs/dbraw/zinc/75/79/03/656757903.db2.gz	GOIVOOORXPAPHJ-NSHDSACASA-N	-2	1	389.260	2.610	20	0		GFADML
CO[C@H]1Cc2ccc([N-]S(=O)(=O)c3ccc(C(=O)[O-])c(Cl)c3)cc2C1	ZINC000783860438	657266028	/nfs/dbraw/zinc/26/60/28/657266028.db2.gz	ZBRMTZPJQQBWPQ-ZDUSSCGKSA-N	-2	1	381.837	2.953	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-c3nncs3)cc2)ccc1F	ZINC000798247648	659088864	/nfs/dbraw/zinc/08/88/64/659088864.db2.gz	YRLLZXIJNPZPHG-UHFFFAOYSA-N	-2	1	379.394	2.843	20	0		GFADML
O=C([O-])c1cc(Br)c(S(=O)(=O)[N-]CC[C@H]2CC2(F)F)s1	ZINC000871993618	662750136	/nfs/dbraw/zinc/75/01/36/662750136.db2.gz	PHAZFXIJPFDHJQ-YFKPBYRVSA-N	-2	1	390.227	2.532	20	0		GFADML
Cc1cc(F)c(Br)cc1[N-]S(=O)(=O)c1cc(C(=O)[O-])n(C)c1	ZINC000190384479	552494473	/nfs/dbraw/zinc/49/44/73/552494473.db2.gz	GZVWMAHOIFGVIT-UHFFFAOYSA-N	-2	1	391.218	2.734	20	0		GFADML
C[C@@H]1C[C@H](NC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])CS1	ZINC000412569297	563661845	/nfs/dbraw/zinc/66/18/45/563661845.db2.gz	HRHVMCARIKEVCU-PWSUYJOCSA-N	-2	1	398.531	2.878	20	0		GFADML
CSCCN(C)C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436585314	563674706	/nfs/dbraw/zinc/67/47/06/563674706.db2.gz	PKQBVVWFNRLYMI-UHFFFAOYSA-N	-2	1	386.520	2.690	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc(-c3ncon3)c2)cc1Cl	ZINC000360406829	563692618	/nfs/dbraw/zinc/69/26/18/563692618.db2.gz	OQIGUPKSPPSJGT-UHFFFAOYSA-N	-2	1	379.781	2.889	20	0		GFADML
CCc1ccc(S(=O)(=O)[N-]c2cccc(C[S@@](C)=O)c2)cc1C(=O)[O-]	ZINC000440823706	563751148	/nfs/dbraw/zinc/75/11/48/563751148.db2.gz	SDNPLSUDLJPGHA-XMMPIXPASA-N	-2	1	381.475	2.627	20	0		GFADML
O=C([O-])Cc1cccc([N-]S(=O)(=O)c2ccc(OC(F)F)c(F)c2)c1	ZINC000447792355	563886520	/nfs/dbraw/zinc/88/65/20/563886520.db2.gz	USHRZWNOXRSMEV-UHFFFAOYSA-N	-2	1	375.324	2.855	20	0		GFADML
O=C([O-])[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000566240432	564318951	/nfs/dbraw/zinc/31/89/51/564318951.db2.gz	WPAMZFQEPLKONC-HQJQHLMTSA-N	-2	1	398.225	2.649	20	0		GFADML
COc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Br)c2)c1	ZINC000476275664	564333478	/nfs/dbraw/zinc/33/34/78/564333478.db2.gz	KKPISGWKKLJGPN-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(N)=O)c(Cl)c2)c(C)c1C(=O)[O-]	ZINC000512786244	564411686	/nfs/dbraw/zinc/41/16/86/564411686.db2.gz	XILSJCTXYINBDY-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cc(Cl)sc1Cl)Cc1cccnc1	ZINC000547568613	564495912	/nfs/dbraw/zinc/49/59/12/564495912.db2.gz	KGSDFAXYGSJULM-VIFPVBQESA-N	-2	1	395.289	2.672	20	0		GFADML
O=C([O-])[C@@H](Cc1cccc(Cl)c1)[N-]S(=O)(=O)c1cc(F)ccc1F	ZINC000548268287	564546211	/nfs/dbraw/zinc/54/62/11/564546211.db2.gz	KJWFGNPPEYXRHZ-CYBMUJFWSA-N	-2	1	375.780	2.592	20	0		GFADML
CN(C)C(=O)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])c1	ZINC000523122657	564662107	/nfs/dbraw/zinc/66/21/07/564662107.db2.gz	OXGHKWHIJIGNMG-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(F)c2)cc1Cl	ZINC000489733416	564750713	/nfs/dbraw/zinc/75/07/13/564750713.db2.gz	FOVPGLPBOXCJLK-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1c(C[S@@](C)=O)cccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(F)c1	ZINC000489738738	564751895	/nfs/dbraw/zinc/75/18/95/564751895.db2.gz	OAAKMIZYOCCWOJ-XMMPIXPASA-N	-2	1	385.438	2.512	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1Cl)C(F)(F)F	ZINC000556774180	564839370	/nfs/dbraw/zinc/83/93/70/564839370.db2.gz	UBIREIJGSZPNQP-LURJTMIESA-N	-2	1	380.171	2.925	20	0		GFADML
CC[C@H](Cc1ccc(NS(=O)(=O)c2csc(C(=O)[O-])c2)cc1)C(=O)[O-]	ZINC000463788051	564890124	/nfs/dbraw/zinc/89/01/24/564890124.db2.gz	IMLWHAJLWXMNRC-LLVKDONJSA-N	-2	1	383.447	2.900	20	0		GFADML
COCc1cccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(Cl)c2)c1	ZINC000500325839	564950422	/nfs/dbraw/zinc/95/04/22/564950422.db2.gz	PLYSAAMQUCSBQV-UHFFFAOYSA-N	-2	1	385.825	2.751	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(Br)cc(C(=O)[O-])c2)cc1O	ZINC000536491438	565038420	/nfs/dbraw/zinc/03/84/20/565038420.db2.gz	LMNWRMGZOIXZJC-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
O=C([O-])CC[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1F)C(F)(F)F	ZINC000663293412	565408152	/nfs/dbraw/zinc/40/81/52/565408152.db2.gz	GLTLTVHGCCDENX-ZETCQYMHSA-N	-2	1	377.743	2.801	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC(C2CC2)C1	ZINC000643290477	565428697	/nfs/dbraw/zinc/42/86/97/565428697.db2.gz	QCXCDYLTKREPQV-UHFFFAOYSA-N	-2	1	378.475	2.737	20	0		GFADML
O=C([O-])[C@H]1CCCCCC[C@H]1[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000646030541	565582460	/nfs/dbraw/zinc/58/24/60/565582460.db2.gz	NPLXMBSLENWYSN-CMPLNLGQSA-N	-2	1	380.388	2.802	20	0		GFADML
O=C([O-])CC1(C[N-]S(=O)(=O)c2ncccc2C(F)(F)F)CCCCC1	ZINC000650392196	565816679	/nfs/dbraw/zinc/81/66/79/565816679.db2.gz	UNSSKWASWHASMT-UHFFFAOYSA-N	-2	1	380.388	2.804	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)CC1CC1	ZINC000650432428	565820970	/nfs/dbraw/zinc/82/09/70/565820970.db2.gz	ZCLMIBWIRRYSDK-MRVPVSSYSA-N	-2	1	398.225	2.507	20	0		GFADML
COc1cc(C(=O)[O-])cc([N-]S(=O)(=O)C[C@@H](C)CC(F)(F)F)c1OC	ZINC000656510365	566129849	/nfs/dbraw/zinc/12/98/49/566129849.db2.gz	DZAVLCKINHBSEL-QMMMGPOBSA-N	-2	1	385.360	2.732	20	0		GFADML
C[C@H](CC(=O)[O-])[N-]S(=O)(=O)c1cc(Cl)c(Cl)cc1Br	ZINC000656509380	566130517	/nfs/dbraw/zinc/13/05/17/566130517.db2.gz	RUZHULGNGALHIP-RXMQYKEDSA-N	-2	1	391.070	2.897	20	0		GFADML
Cc1c(C(=O)[O-])cc(Cl)cc1S(=O)(=O)[N-]c1ccccc1CC(=O)[O-]	ZINC000820940071	597513431	/nfs/dbraw/zinc/51/34/31/597513431.db2.gz	CPLPIOBGKXHRSF-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2cccc(C)c2C(=O)[O-])cc1	ZINC000737605718	599853057	/nfs/dbraw/zinc/85/30/57/599853057.db2.gz	TYVAVKROEUSQJG-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
O=C([O-])CCc1ccc([N-]S(=O)(=O)c2ccc(CCC(=O)[O-])cc2)cc1	ZINC000739767632	599854169	/nfs/dbraw/zinc/85/41/69/599854169.db2.gz	WJOGJNPMYRDFPJ-UHFFFAOYSA-N	-3	1	377.418	2.522	20	0		GFADML
COC(=O)c1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(SC)cc2)c1	ZINC000737654599	599878802	/nfs/dbraw/zinc/87/88/02/599878802.db2.gz	QIYSQEWBWAWWAQ-UHFFFAOYSA-N	-2	1	381.431	2.694	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(Cl)c(C(=O)N(C)C)c1	ZINC000477428305	599906598	/nfs/dbraw/zinc/90/65/98/599906598.db2.gz	NTNZMEQRAAZIHI-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C)c2)c1	ZINC000592712886	600054116	/nfs/dbraw/zinc/05/41/16/600054116.db2.gz	KDFCPROPGIKMKP-UHFFFAOYSA-N	-2	1	397.474	2.514	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)ccc1F	ZINC000737154460	600302071	/nfs/dbraw/zinc/30/20/71/600302071.db2.gz	WKDZFQWLJHDYBJ-UHFFFAOYSA-N	-2	1	396.396	2.571	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(CNC(=O)[O-])cc2)c1C	ZINC000738346271	600303054	/nfs/dbraw/zinc/30/30/54/600303054.db2.gz	ZUGNUXQJUJOBBC-UHFFFAOYSA-N	-3	1	378.406	2.570	20	0		GFADML
C[C@@H]1CCCC[C@H]1CCNC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736777772	600424740	/nfs/dbraw/zinc/42/47/40/600424740.db2.gz	DGLXZDFJEGKOMU-CABCVRRESA-N	-2	1	385.464	2.739	20	0		GFADML
O=C([O-])CCCOc1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)oc3c2)cc1	ZINC000739687844	600489840	/nfs/dbraw/zinc/48/98/40/600489840.db2.gz	YAMRRVZILQOMOD-UHFFFAOYSA-N	-2	1	392.389	2.578	20	0		GFADML
CC(C)[C@@H]1CCCN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CC1	ZINC000736395956	600499357	/nfs/dbraw/zinc/49/93/57/600499357.db2.gz	SLONJEMNMCRILW-OAHLLOKOSA-N	-2	1	385.464	2.691	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)cc1Cl	ZINC000609819509	600545276	/nfs/dbraw/zinc/54/52/76/600545276.db2.gz	QBJYOPIBICDBEW-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(OC)c(Cl)c2)cc1C(=O)[O-]	ZINC000831435088	600689539	/nfs/dbraw/zinc/68/95/39/600689539.db2.gz	NSGHZMDIWQOMHC-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]CCC(F)(F)F)c(F)cc1Br	ZINC000833304988	600801139	/nfs/dbraw/zinc/80/11/39/600801139.db2.gz	RMXNKSFRVUHTJC-UHFFFAOYSA-N	-2	1	394.140	2.517	20	0		GFADML
CSc1nc(C)c(CCC(=O)N2C[C@H](CC(=O)[O-])c3ccccc32)c(=O)[n-]1	ZINC000738210145	600863340	/nfs/dbraw/zinc/86/33/40/600863340.db2.gz	QISNONGARYPQIG-LBPRGKRZSA-N	-2	1	387.461	2.750	20	0		GFADML
CCN(Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(C)c1)C(C)=O	ZINC000506687391	600888889	/nfs/dbraw/zinc/88/88/89/600888889.db2.gz	ALZMBBJTZHKMLP-UHFFFAOYSA-N	-2	1	390.461	2.862	20	0		GFADML
Cc1nc(-c2ccc([N-]S(=O)(=O)c3cc(Cl)cc(C(=O)[O-])c3)cc2)n[nH]1	ZINC000738819711	600892514	/nfs/dbraw/zinc/89/25/14/600892514.db2.gz	CFLFGUUUVHQCFI-UHFFFAOYSA-N	-2	1	392.824	2.933	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2c3nsnc3ccc2Cl)cc1	ZINC000324985591	601117832	/nfs/dbraw/zinc/11/78/32/601117832.db2.gz	QYGUDEHXHYDZBV-UHFFFAOYSA-N	-2	1	383.838	2.773	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)c1ccc(C(=O)CCC(=O)[O-])cc1	ZINC000832919161	601127487	/nfs/dbraw/zinc/12/74/87/601127487.db2.gz	WLLZORUMMUALHL-UHFFFAOYSA-N	-3	1	391.401	2.542	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](c2ccccc2)[C@@H](C)C(=O)[O-])c(F)c1	ZINC000681579797	601225134	/nfs/dbraw/zinc/22/51/34/601225134.db2.gz	VRUPFIOXWGERHZ-MEBBXXQBSA-N	-2	1	385.388	2.714	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2ccc3nc(C4CC4)oc3c2)cc1	ZINC000432211184	601234637	/nfs/dbraw/zinc/23/46/37/601234637.db2.gz	VAXRGJAEBBSACA-UHFFFAOYSA-N	-2	1	388.401	2.969	20	0		GFADML
CO[C@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])c(Cl)cc1Cl)C(F)(F)F	ZINC000831519724	601244590	/nfs/dbraw/zinc/24/45/90/601244590.db2.gz	QMVHFMAAXUMUKR-SECBINFHSA-N	-2	1	396.170	2.547	20	0		GFADML
COC[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])c(Cl)cc1Cl)c1ccco1	ZINC000831654440	601263012	/nfs/dbraw/zinc/26/30/12/601263012.db2.gz	AHZYNZWKHYZFQQ-LLVKDONJSA-N	-2	1	394.232	2.951	20	0		GFADML
O=C([O-])c1cc(C(=O)Nc2cccc(S(=O)(=O)[N-]c3ccccc3)c2)ccn1	ZINC000833160011	601278583	/nfs/dbraw/zinc/27/85/83/601278583.db2.gz	QTJGPHKZLVDUFW-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
CCCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000013362601	601318665	/nfs/dbraw/zinc/31/86/65/601318665.db2.gz	KSZRTBQFGVZYJK-UHFFFAOYSA-N	-2	1	381.381	2.892	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)ccc1F	ZINC000747608889	601322352	/nfs/dbraw/zinc/32/23/52/601322352.db2.gz	LVCRUBMOQRPVFO-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1nscc1S(=O)(=O)[N-]c1cc(-c2cccc(Cl)c2)n[nH]1	ZINC000833344881	601487919	/nfs/dbraw/zinc/48/79/19/601487919.db2.gz	GGKXHQXSJFSEBH-UHFFFAOYSA-N	-2	1	384.826	2.686	20	0		GFADML
Cc1cc(C)cc(-c2cc([N-]S(=O)(=O)c3csnc3C(=O)[O-])[nH]n2)c1	ZINC000832874533	601488226	/nfs/dbraw/zinc/48/82/26/601488226.db2.gz	IVCUUOSQEXNUTG-UHFFFAOYSA-N	-2	1	378.435	2.649	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cc(-c2ccccc2C)n[nH]1	ZINC000444419674	601603883	/nfs/dbraw/zinc/60/38/83/601603883.db2.gz	ATLUTKOUDTZGDA-UHFFFAOYSA-N	-2	1	387.417	2.893	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(N3CCOC3=O)cc2)ccc1Cl	ZINC000833305845	601829736	/nfs/dbraw/zinc/82/97/36/601829736.db2.gz	GCACAHAFNFJAPF-UHFFFAOYSA-N	-2	1	396.808	2.796	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2C)cc(F)c1F	ZINC000755975467	601833319	/nfs/dbraw/zinc/83/33/19/601833319.db2.gz	RZGCSMJYLSCBOX-UHFFFAOYSA-N	-2	1	385.344	2.559	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)ccc1F	ZINC000751146375	601833397	/nfs/dbraw/zinc/83/33/97/601833397.db2.gz	LIEIKGRCDQMXGN-UHFFFAOYSA-N	-2	1	388.323	2.561	20	0		GFADML
CC1(C)Oc2ccc([N-]S(=O)(=O)c3cc(F)c(F)c(C(=O)[O-])c3)cc2O1	ZINC000751147850	601835350	/nfs/dbraw/zinc/83/53/50/601835350.db2.gz	WEFNIMLXWZRWSK-UHFFFAOYSA-N	-2	1	385.344	2.971	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(Cn3cccn3)cc2)cc(F)c1F	ZINC000751145925	601835379	/nfs/dbraw/zinc/83/53/79/601835379.db2.gz	MHUSDIAXZCDQKE-UHFFFAOYSA-N	-2	1	393.371	2.709	20	0		GFADML
CC1(C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3cccc(NC(=O)[O-])c3)cc21	ZINC000828045808	601836554	/nfs/dbraw/zinc/83/65/54/601836554.db2.gz	BWQUICJEXHUORX-UHFFFAOYSA-N	-2	1	375.406	2.807	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3cccc(F)c3C(=O)[O-])c2)n[nH]1	ZINC000832991604	601863414	/nfs/dbraw/zinc/86/34/14/601863414.db2.gz	XORFSLPWSQUFHP-UHFFFAOYSA-N	-2	1	390.396	2.727	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(OCC(F)F)cc1	ZINC000833295272	601863621	/nfs/dbraw/zinc/86/36/21/601863621.db2.gz	UDPBXACVXBNZBQ-UHFFFAOYSA-N	-2	1	375.324	2.969	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(C(=O)OCCNC(=O)[O-])ccc2C)c1	ZINC000832972577	602257679	/nfs/dbraw/zinc/25/76/79/602257679.db2.gz	FFSMYBKYNVJYHM-UHFFFAOYSA-N	-2	1	392.433	2.529	20	0		GFADML
O=C([O-])N1CCCc2cc([N-]S(=O)(=O)c3cccc4c3COC4=O)ccc21	ZINC000740733293	602646984	/nfs/dbraw/zinc/64/69/84/602646984.db2.gz	VCSUSSCAIOOUOH-UHFFFAOYSA-N	-2	1	388.401	2.588	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccccc2CN(C)C(=O)[O-])c1C	ZINC000739789868	602654769	/nfs/dbraw/zinc/65/47/69/602654769.db2.gz	VRXSZRIIWMWCHL-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
O=C([O-])NCc1nc(C(=O)[N-]c2nnc(Cc3cccc(F)c3)s2)cs1	ZINC000740685814	602704245	/nfs/dbraw/zinc/70/42/45/602704245.db2.gz	QBUXJMIPBGQLEY-UHFFFAOYSA-N	-2	1	393.425	2.744	20	0		GFADML
CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000739398413	602847074	/nfs/dbraw/zinc/84/70/74/602847074.db2.gz	WCAKSYPPXMFATH-UHFFFAOYSA-N	-2	1	387.392	2.592	20	0		GFADML
CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])C1CC1	ZINC000738718671	603103443	/nfs/dbraw/zinc/10/34/43/603103443.db2.gz	ZOOMXNYAYXKCJT-CYBMUJFWSA-N	-2	1	379.413	2.515	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)c1C	ZINC000828800045	603401475	/nfs/dbraw/zinc/40/14/75/603401475.db2.gz	UPOYCRZAWQKQRZ-LBPRGKRZSA-N	-2	1	392.433	2.911	20	0		GFADML
C[C@@H](NC(=O)[O-])c1ccc(NS(=O)(=O)c2ccc(C(=O)[O-])cc2F)cc1	ZINC000825448642	603402307	/nfs/dbraw/zinc/40/23/07/603402307.db2.gz	GGRUQEWJSYIPHD-SECBINFHSA-N	-2	1	382.369	2.653	20	0		GFADML
CCN(CC(=O)Nc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2)c1)C(=O)[O-]	ZINC000739395727	603423326	/nfs/dbraw/zinc/42/33/26/603423326.db2.gz	CIXKBXSQKOWVRV-UHFFFAOYSA-N	-2	1	391.449	2.734	20	0		GFADML
CCc1cc2c(COC(=O)[C@H]3CCC[C@@H](NC(=O)[O-])C3)cc(=O)oc2cc1[O-]	ZINC000827568473	603872924	/nfs/dbraw/zinc/87/29/24/603872924.db2.gz	BXQOQUPNYROWSW-GXTWGEPZSA-N	-2	1	389.404	2.931	20	0		GFADML
O=C([O-])NC[C@@H](C(=O)OCc1cc(=O)oc2cc([O-])ccc12)c1ccccc1	ZINC000832414286	603925975	/nfs/dbraw/zinc/92/59/75/603925975.db2.gz	IEIBWWAIHNILKQ-MRXNPFEDSA-N	-2	1	383.356	2.593	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCCC2CCN(CC(F)(F)F)CC2)c([O-])c1	ZINC000832832751	604117856	/nfs/dbraw/zinc/11/78/56/604117856.db2.gz	CGGDUKOBPUBOHL-UHFFFAOYSA-N	-2	1	389.374	2.876	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)ccc1F	ZINC000767735494	604631479	/nfs/dbraw/zinc/63/14/79/604631479.db2.gz	HJRBJHCWCUTSDB-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
Cc1c(S(=O)(=O)[N-]c2cc(NC(=O)[O-])ccc2F)cnn1-c1ccccn1	ZINC000829888510	604644257	/nfs/dbraw/zinc/64/42/57/604644257.db2.gz	FJYGNSNDVJWYTA-UHFFFAOYSA-N	-2	1	391.384	2.606	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])c(F)c2)c1C	ZINC000833716785	605264815	/nfs/dbraw/zinc/26/48/15/605264815.db2.gz	QSGSNKHDTWZEPF-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCOC[C@@H]2C[C@@H](O)c2cccs2)c([O-])c1	ZINC000834258551	605655980	/nfs/dbraw/zinc/65/59/80/605655980.db2.gz	QMZWRSWZISUEAD-SWLSCSKDSA-N	-2	1	392.433	2.508	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000013278917	654504006	/nfs/dbraw/zinc/50/40/06/654504006.db2.gz	SNAYLDOVCDYOOA-UHFFFAOYSA-N	-3	1	384.391	2.521	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(SC)cc2)c(C(=O)[O-])cc1OC	ZINC000064474985	654869747	/nfs/dbraw/zinc/86/97/47/654869747.db2.gz	NSMVLZIXPLCPHZ-UHFFFAOYSA-N	-2	1	383.447	2.925	20	0		GFADML
CCS(=O)(=O)[N-]c1cc(OC)ccc1S(=O)(=O)[N-]c1ccccc1C	ZINC000270523741	655047896	/nfs/dbraw/zinc/04/78/96/655047896.db2.gz	SFEIFZGQOGIYTB-UHFFFAOYSA-N	-2	1	384.479	2.566	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(C)c(C)s2)cc1[N-]S(C)(=O)=O	ZINC000271370036	655078049	/nfs/dbraw/zinc/07/80/49/655078049.db2.gz	KSGWQKQEZNZFSA-UHFFFAOYSA-N	-2	1	390.508	2.546	20	0		GFADML
CN(C)C(=O)Sc1ccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])cc1	ZINC000737352576	655671395	/nfs/dbraw/zinc/67/13/95/655671395.db2.gz	SCUKINUJEKPHBV-UHFFFAOYSA-N	-2	1	380.447	2.959	20	0		GFADML
O=S(=O)([N-]c1cc(F)cc(N2CCOCC2)c1)c1cccc(Cl)c1[O-]	ZINC000753014347	655849271	/nfs/dbraw/zinc/84/92/71/655849271.db2.gz	GDQMSSWJQJETFR-UHFFFAOYSA-N	-2	1	386.832	2.822	20	0		GFADML
COC[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cc(C)c1Cl)c1ccc(C)o1	ZINC000761308986	656009930	/nfs/dbraw/zinc/00/99/30/656009930.db2.gz	KWFZACLOFOYCHC-GFCCVEGCSA-N	-2	1	387.841	2.914	20	0		GFADML
Cc1cc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)cc(C(=O)[O-])c1	ZINC000795367436	658811839	/nfs/dbraw/zinc/81/18/39/658811839.db2.gz	YVSGJNLPWTYVNZ-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
C[C@H]1CCN(C(=O)c2c([O-])cccc2Cl)[C@@H](C)[C@H]1[N-]C(=O)C(F)(F)F	ZINC000813634794	660058480	/nfs/dbraw/zinc/05/84/80/660058480.db2.gz	DTPFPCPPEFMIME-RVBZMBCESA-N	-2	1	378.778	2.963	20	0		GFADML
O=S(=O)([N-]c1cc2n(n1)CCCC2)c1c([O-])cccc1OC(F)(F)F	ZINC000901922650	663751220	/nfs/dbraw/zinc/75/12/20/663751220.db2.gz	BFFKWKZAGRVHTE-UHFFFAOYSA-N	-2	1	377.344	2.624	20	0		GFADML
CSCC1CCC([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CC1	ZINC000395477347	677411343	/nfs/dbraw/zinc/41/13/43/677411343.db2.gz	WEVNOQSYFSDQPX-UHFFFAOYSA-N	-2	1	379.450	2.863	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(C(N)=O)c(Cl)c2)c1C	ZINC000031720949	551130329	/nfs/dbraw/zinc/13/03/29/551130329.db2.gz	XZNXELZRIFVNPX-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2[N-]S(C)(=O)=O)cc1Cl	ZINC000179764726	552202296	/nfs/dbraw/zinc/20/22/96/552202296.db2.gz	KIRHXWVLDNZMOP-UHFFFAOYSA-N	-2	1	392.861	2.960	20	0		GFADML
O=C([O-])[C@@H](CC(F)F)[N-]S(=O)(=O)c1cc(Br)sc1Cl	ZINC000548534980	564556029	/nfs/dbraw/zinc/55/60/29/564556029.db2.gz	JSHQQWNORKXCFZ-GSVOUGTGSA-N	-2	1	398.634	2.551	20	0		GFADML
CS[C@@H]1CCN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C1	ZINC000295480002	563249604	/nfs/dbraw/zinc/24/96/04/563249604.db2.gz	DCHILDUNLZNKSX-GFCCVEGCSA-N	-2	1	398.531	2.832	20	0		GFADML
CS[C@H]1CCN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C1	ZINC000295480007	563249614	/nfs/dbraw/zinc/24/96/14/563249614.db2.gz	DCHILDUNLZNKSX-LBPRGKRZSA-N	-2	1	398.531	2.832	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)ccc1F	ZINC000393108092	563528759	/nfs/dbraw/zinc/52/87/59/563528759.db2.gz	GOTGTYNROGSJCB-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
O=C(NCCC(F)(F)F)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436578402	563674371	/nfs/dbraw/zinc/67/43/71/563674371.db2.gz	WQSVLLGSKMPNMP-UHFFFAOYSA-N	-2	1	394.396	2.937	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)cc1C	ZINC000438762819	563710185	/nfs/dbraw/zinc/71/01/85/563710185.db2.gz	FAZDRKJERVSHJW-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2C(=O)[O-])cc1Cl	ZINC000438778511	563710604	/nfs/dbraw/zinc/71/06/04/563710604.db2.gz	XIAAUDDPLHVHPC-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000506577748	564205375	/nfs/dbraw/zinc/20/53/75/564205375.db2.gz	JIRJDOMVFDBNEG-UHFFFAOYSA-N	-3	1	381.431	2.914	20	0		GFADML
C[C@H](C[N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl)C(=O)[O-]	ZINC000568156606	564406994	/nfs/dbraw/zinc/40/69/94/564406994.db2.gz	GCRNZRGPBVSOEX-RXMQYKEDSA-N	-2	1	391.070	2.755	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2cccc([S@@](C)=O)c2)cc1C(=O)[O-]	ZINC000479260554	564433892	/nfs/dbraw/zinc/43/38/92/564433892.db2.gz	GFNBMHSEWZUKEW-HSZRJFAPSA-N	-2	1	387.866	2.885	20	0		GFADML
C[S@](=O)Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(Cl)c1	ZINC000547244958	564481619	/nfs/dbraw/zinc/48/16/19/564481619.db2.gz	FJGIRDFHYYXDKU-QHCPKHFHSA-N	-2	1	387.866	2.718	20	0		GFADML
O=C([O-])[C@H](CC1CCCC1)[N-]S(=O)(=O)c1sccc1Br	ZINC000547571054	564495707	/nfs/dbraw/zinc/49/57/07/564495707.db2.gz	RSTOLBRGRNGFKM-JTQLQIEISA-N	-2	1	382.301	2.822	20	0		GFADML
O=C([O-])[C@H](Cc1cccc(Cl)c1)[N-]S(=O)(=O)c1cccc(F)c1F	ZINC000547936843	564523389	/nfs/dbraw/zinc/52/33/89/564523389.db2.gz	SULDVWYZZVLTBK-LBPRGKRZSA-N	-2	1	375.780	2.592	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000548210196	564536885	/nfs/dbraw/zinc/53/68/85/564536885.db2.gz	FBIYWLMWBLJMNP-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
O=C([O-])[C@H](Cc1c(F)cccc1Cl)[N-]S(=O)(=O)c1cccc(F)c1F	ZINC000548262878	564544382	/nfs/dbraw/zinc/54/43/82/564544382.db2.gz	DXCOOLVEPPNGPB-LBPRGKRZSA-N	-2	1	393.770	2.732	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(Cl)cc1C(=O)[O-]	ZINC000518645278	564558460	/nfs/dbraw/zinc/55/84/60/564558460.db2.gz	ZUSOHNUQSDAQTA-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])cc1Cl	ZINC000484560708	564591132	/nfs/dbraw/zinc/59/11/32/564591132.db2.gz	XSEWNZNNUMLFIN-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(Cl)c2)cc1F	ZINC000500296507	564949736	/nfs/dbraw/zinc/94/97/36/564949736.db2.gz	KLIXVMAFIBSLHK-UHFFFAOYSA-N	-2	1	389.788	2.752	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C1CCC1	ZINC000663253698	565404372	/nfs/dbraw/zinc/40/43/72/565404372.db2.gz	BLDMWZRAYKQWNA-QMMMGPOBSA-N	-2	1	398.225	2.507	20	0		GFADML
Cc1ccc(C[N-]S(=O)(=O)c2csnc2C(=O)[O-])c(OC(C)(C)C)c1	ZINC000645987259	565580225	/nfs/dbraw/zinc/58/02/25/565580225.db2.gz	GYTJKVZBTSKPPH-UHFFFAOYSA-N	-2	1	384.479	2.806	20	0		GFADML
O=C([O-])[C@@H]1CCCCCC[C@H]1[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000646030544	565582890	/nfs/dbraw/zinc/58/28/90/565582890.db2.gz	NPLXMBSLENWYSN-ZYHUDNBSSA-N	-2	1	380.388	2.802	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(C(=O)N(C)[C@H](C)C(=O)[O-])cc2)c1	ZINC000262926338	597458287	/nfs/dbraw/zinc/45/82/87/597458287.db2.gz	WKDFYGPSHHFYCT-CQSZACIVSA-N	-2	1	390.461	2.649	20	0		GFADML
O=C([O-])[C@H](CNC(=O)c1ccc(Br)cc1[O-])Cc1ccc(O)cc1	ZINC000739396842	599718288	/nfs/dbraw/zinc/71/82/88/599718288.db2.gz	KDYVNLJOGKUNOM-NSHDSACASA-N	-2	1	394.221	2.534	20	0		GFADML
O=C([O-])CCc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000739766997	599853788	/nfs/dbraw/zinc/85/37/88/599853788.db2.gz	PYWFVJHTZRRANT-UHFFFAOYSA-N	-3	1	383.809	2.856	20	0		GFADML
Cc1cc(C)n(-c2ccc([N-]S(=O)(=O)c3cccc(C(=O)[O-])c3C)cn2)n1	ZINC000477417182	599906273	/nfs/dbraw/zinc/90/62/73/599906273.db2.gz	GVVIMPRZKARWBE-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
CSc1cc2c(cc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1C)OCCO2	ZINC000477428230	599907304	/nfs/dbraw/zinc/90/73/04/599907304.db2.gz	QHSJKYNYGIHTRO-UHFFFAOYSA-N	-2	1	395.458	2.987	20	0		GFADML
CC(=O)Nc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(O)c(C(=O)[O-])c1	ZINC000736158588	599938515	/nfs/dbraw/zinc/93/85/15/599938515.db2.gz	VJQRKODXOYNEMF-UHFFFAOYSA-N	-2	1	384.797	2.503	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(OC)c(Cl)c2)cc(C(=O)[O-])c1	ZINC000737664014	600023210	/nfs/dbraw/zinc/02/32/10/600023210.db2.gz	DZULTHIFIHETIX-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
CCn1cnnc1-c1cccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])c1	ZINC000737304229	600095909	/nfs/dbraw/zinc/09/59/09/600095909.db2.gz	YNKKWOVAAVRCIH-UHFFFAOYSA-N	-2	1	390.396	2.603	20	0		GFADML
CCOC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)c1	ZINC000737155733	600100318	/nfs/dbraw/zinc/10/03/18/600100318.db2.gz	UJWFRMQZFSVNCI-UHFFFAOYSA-N	-2	1	382.369	2.893	20	0		GFADML
O=C([O-])c1ccc(N2CCCC2)c([N-]S(=O)(=O)c2ccc3c(c2)CCO3)c1	ZINC000740143632	600106112	/nfs/dbraw/zinc/10/61/12/600106112.db2.gz	ILTXNFHUJDKPKT-UHFFFAOYSA-N	-2	1	388.445	2.721	20	0		GFADML
C[S@](=O)Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(C(=O)[O-])s2)c1	ZINC000738179693	600302603	/nfs/dbraw/zinc/30/26/03/600302603.db2.gz	LWHFZUZMNWIOSX-QFIPXVFZSA-N	-2	1	393.895	2.779	20	0		GFADML
C[S@@](=O)Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(C(=O)[O-])s2)c1	ZINC000738179692	600303003	/nfs/dbraw/zinc/30/30/03/600303003.db2.gz	LWHFZUZMNWIOSX-JOCHJYFZSA-N	-2	1	393.895	2.779	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)ccc1OCC(=O)[O-]	ZINC000738477121	600637742	/nfs/dbraw/zinc/63/77/42/600637742.db2.gz	RLPBHAPUKSZKST-UHFFFAOYSA-N	-3	1	399.808	2.611	20	0		GFADML
CCc1ccc([C@H](COC)[N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)o1	ZINC000761309618	600762892	/nfs/dbraw/zinc/76/28/92/600762892.db2.gz	MERQCDDRQBHFNM-ZDUSSCGKSA-N	-2	1	387.841	2.860	20	0		GFADML
CCCc1cc(=O)[n-]c(S[C@H]2CCN(c3sccc3C(=O)[O-])C2=O)n1	ZINC000829566401	600804252	/nfs/dbraw/zinc/80/42/52/600804252.db2.gz	LCQTZHTWPKMZTR-NSHDSACASA-N	-2	1	379.463	2.792	20	0		GFADML
CCn1cnnc1-c1ccccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)[O-])c1	ZINC000574108738	600810987	/nfs/dbraw/zinc/81/09/87/600810987.db2.gz	UUHIUBFVLFTUDW-UHFFFAOYSA-N	-2	1	386.433	2.772	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)c(F)c2)cc1C(=O)[O-]	ZINC000483119121	600815729	/nfs/dbraw/zinc/81/57/29/600815729.db2.gz	OZCRLDNDABCSBP-UHFFFAOYSA-N	-2	1	392.408	2.760	20	0		GFADML
CSc1nc(C)c(CCC(=O)N2C[C@@H](CC(=O)[O-])c3ccccc32)c(=O)[n-]1	ZINC000738210138	600863298	/nfs/dbraw/zinc/86/32/98/600863298.db2.gz	QISNONGARYPQIG-GFCCVEGCSA-N	-2	1	387.461	2.750	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(-c3ncon3)cc2)c1	ZINC000740075761	600892720	/nfs/dbraw/zinc/89/27/20/600892720.db2.gz	OLBLGHXNFIWNJA-UHFFFAOYSA-N	-2	1	379.781	2.889	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)cc1C	ZINC000484991558	600899462	/nfs/dbraw/zinc/89/94/62/600899462.db2.gz	YLYUXDPCQORURV-UHFFFAOYSA-N	-2	1	391.445	2.945	20	0		GFADML
C[C@@H]1CN(c2ccc([N-]S(=O)(=O)c3csc(C(=O)[O-])c3)cc2)C[C@H](C)O1	ZINC000747407974	600980861	/nfs/dbraw/zinc/98/08/61/600980861.db2.gz	KDVQFUFIFYRFEO-TXEJJXNPSA-N	-2	1	396.490	2.861	20	0		GFADML
COc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1	ZINC000737950097	601118057	/nfs/dbraw/zinc/11/80/57/601118057.db2.gz	XGOISUDIBSZJJC-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1C(=O)N(C)C	ZINC000832952930	601250971	/nfs/dbraw/zinc/25/09/71/601250971.db2.gz	NGERWCJNMYPFAE-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
Cn1cc(NC(=O)c2cccc([N-]S(=O)(=O)c3ccccc3)c2)cc1C(=O)[O-]	ZINC000833051683	601319709	/nfs/dbraw/zinc/31/97/09/601319709.db2.gz	WHTTWBXHCBWYEN-UHFFFAOYSA-N	-2	1	399.428	2.776	20	0		GFADML
Cc1ccc(C(=O)N(C)C)cc1[N-]S(=O)(=O)c1cc(C(=O)[O-])cc(C)c1C	ZINC000298841978	601322973	/nfs/dbraw/zinc/32/29/73/601322973.db2.gz	GSLQBZRAGHCIGP-UHFFFAOYSA-N	-2	1	390.461	2.813	20	0		GFADML
CCCNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000829519671	601323375	/nfs/dbraw/zinc/32/33/75/601323375.db2.gz	OCVQPQVHGSYNKW-FLIBITNWSA-N	-2	1	388.445	2.725	20	0		GFADML
COCCOCc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000614839172	601324666	/nfs/dbraw/zinc/32/46/66/601324666.db2.gz	YYASWHSCMUBRGX-UHFFFAOYSA-N	-2	1	393.461	2.965	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-c3csnn3)cc2)ccc1F	ZINC000057120269	601325776	/nfs/dbraw/zinc/32/57/76/601325776.db2.gz	UBGGUSSTNXGBSK-UHFFFAOYSA-N	-2	1	379.394	2.843	20	0		GFADML
Cc1nc(-c2cccc([N-]S(=O)(=O)c3ccc(F)c(C(=O)[O-])c3)c2)no1	ZINC000063849571	601326422	/nfs/dbraw/zinc/32/64/22/601326422.db2.gz	OZYCCWBXHRQASA-UHFFFAOYSA-N	-2	1	377.353	2.683	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000619533511	601327293	/nfs/dbraw/zinc/32/72/93/601327293.db2.gz	VLDJHCJWHSRTMH-UHFFFAOYSA-N	-3	1	379.390	2.509	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)c1	ZINC000831248002	601330455	/nfs/dbraw/zinc/33/04/55/601330455.db2.gz	ILOOPWCVKQDJRB-UHFFFAOYSA-N	-2	1	391.445	2.908	20	0		GFADML
COc1cc(C(=O)[O-])cc([N-]S(=O)(=O)/C=C\c2ccc(F)cc2)c1OC	ZINC000751142619	601332801	/nfs/dbraw/zinc/33/28/01/601332801.db2.gz	NNCGOSQZKGTUQX-FPLPWBNLSA-N	-2	1	381.381	2.954	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)ccc1C(=O)N(C)C	ZINC000832899896	601332946	/nfs/dbraw/zinc/33/29/46/601332946.db2.gz	UPJPGSZXLJUTQA-WDZFZDKYSA-N	-2	1	388.445	2.595	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])ccc1Br	ZINC000832030615	601333840	/nfs/dbraw/zinc/33/38/40/601333840.db2.gz	VEOIKVRHUBPKOC-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(N2CCCC2)cc1	ZINC000013059312	601359525	/nfs/dbraw/zinc/35/95/25/601359525.db2.gz	XFPGDHGGWFMACO-UHFFFAOYSA-N	-2	1	376.434	2.794	20	0		GFADML
C/C(=C/COC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(C)c2)c1)C(=O)[O-]	ZINC000825781056	601405847	/nfs/dbraw/zinc/40/58/47/601405847.db2.gz	OMKKHIWZRWLMKI-ZROIWOOFSA-N	-2	1	389.429	2.984	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(OCC(F)F)cc1	ZINC000833317956	601476148	/nfs/dbraw/zinc/47/61/48/601476148.db2.gz	BHWQGZWSGJUCFT-UHFFFAOYSA-N	-2	1	375.324	2.969	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)[O-])cc1C	ZINC000466291252	601575920	/nfs/dbraw/zinc/57/59/20/601575920.db2.gz	VJLKTMKSBZHQMB-UHFFFAOYSA-N	-2	1	393.417	2.981	20	0		GFADML
O=C([O-])[C@H]1CCCCN1C(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000262604556	601743926	/nfs/dbraw/zinc/74/39/26/601743926.db2.gz	ZNDHITHTWLALBL-QGZVFWFLSA-N	-2	1	388.445	2.567	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3cccc(C(=O)[O-])c3C)ccc2o1	ZINC000831795974	601795177	/nfs/dbraw/zinc/79/51/77/601795177.db2.gz	VTOIQGFNUSUTFA-UHFFFAOYSA-N	-2	1	390.417	2.824	20	0		GFADML
CCCNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000829519506	601827868	/nfs/dbraw/zinc/82/78/68/601827868.db2.gz	KNKPSCHVUBZSMC-UHFFFAOYSA-N	-2	1	396.852	2.979	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1OC	ZINC000751146612	601832013	/nfs/dbraw/zinc/83/20/13/601832013.db2.gz	OQRBQTKJNJJSSW-UHFFFAOYSA-N	-2	1	387.360	2.871	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C)cc2C(=O)[O-])cc(F)c1F	ZINC000755966186	601835431	/nfs/dbraw/zinc/83/54/31/601835431.db2.gz	BHHKAXMZIXEXJJ-UHFFFAOYSA-N	-2	1	385.344	2.559	20	0		GFADML
CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C(=O)OC)[nH]n1	ZINC000829215333	601861691	/nfs/dbraw/zinc/86/16/91/601861691.db2.gz	AKMBBHBKHIQLLJ-SNVBAGLBSA-N	-2	1	395.437	2.599	20	0		GFADML
C[C@@H](CC(=O)[O-])C(=O)N(C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000827248377	602144510	/nfs/dbraw/zinc/14/45/10/602144510.db2.gz	ZDOCLDVNGXSCGO-AWEZNQCLSA-N	-2	1	390.461	2.557	20	0		GFADML
O=C([O-])c1nscc1S(=O)(=O)[N-]c1ccc2nc(C3CCC3)[nH]c2c1	ZINC000833346523	602169609	/nfs/dbraw/zinc/16/96/09/602169609.db2.gz	RBHHBKBAAKKTKO-UHFFFAOYSA-N	-2	1	378.435	2.786	20	0		GFADML
Cc1ccc(C(=O)N[C@H](C)C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(Cl)c1	ZINC000426689040	602252975	/nfs/dbraw/zinc/25/29/75/602252975.db2.gz	TZNZKVVMNLABOX-LLVKDONJSA-N	-2	1	396.852	2.652	20	0		GFADML
CCCc1cc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2C(=O)[O-])[nH]n1	ZINC000829566048	602306113	/nfs/dbraw/zinc/30/61/13/602306113.db2.gz	AHJHABQGKLBQBB-UHFFFAOYSA-N	-2	1	377.344	2.880	20	0		GFADML
COCCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CN(C(=O)[O-])CC3)cc1	ZINC000739836049	602490810	/nfs/dbraw/zinc/49/08/10/602490810.db2.gz	DQUZIZROHOZOGW-UHFFFAOYSA-N	-2	1	390.461	2.712	20	0		GFADML
O=C([O-])N1CCCc2cc([N-]S(=O)(=O)c3ccc4c(c3)OCCO4)ccc21	ZINC000740524249	602646755	/nfs/dbraw/zinc/64/67/55/602646755.db2.gz	UHOOMHXHHQBBCO-UHFFFAOYSA-N	-2	1	390.417	2.689	20	0		GFADML
CCN(Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCO2)C(=O)[O-]	ZINC000739443229	602653892	/nfs/dbraw/zinc/65/38/92/602653892.db2.gz	CTRNTPZGXHMZFP-UHFFFAOYSA-N	-2	1	376.434	2.922	20	0		GFADML
CN(Cc1ccccc1N1CCOCC1)C(=O)c1ccc(NC(=O)[O-])cc1[O-]	ZINC000739712283	602842828	/nfs/dbraw/zinc/84/28/28/602842828.db2.gz	VDWDQRVUAYRHRV-UHFFFAOYSA-N	-2	1	385.420	2.591	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2ccccc2CN2CCCC2=O)c([O-])c1	ZINC000740697898	602847785	/nfs/dbraw/zinc/84/77/85/602847785.db2.gz	KLFREAWIZHJZLR-UHFFFAOYSA-N	-2	1	383.404	2.535	20	0		GFADML
C[C@H]1CCCN(C(=O)C2CCN(C(=O)c3ccc(NC(=O)[O-])cc3[O-])CC2)C1	ZINC000739102871	602848885	/nfs/dbraw/zinc/84/88/85/602848885.db2.gz	INDZBFYURNLHNE-ZDUSSCGKSA-N	-2	1	389.452	2.593	20	0		GFADML
COC(=O)[C@H](CNC(=O)c1ccc(NC(=O)[O-])cc1[O-])Cc1cccc(C)c1	ZINC000739759199	602860369	/nfs/dbraw/zinc/86/03/69/602860369.db2.gz	OULKDOXIJRHAOV-AWEZNQCLSA-N	-2	1	386.404	2.552	20	0		GFADML
CN(C(=O)OC(C)(C)C)C1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])CC1	ZINC000739592979	602862816	/nfs/dbraw/zinc/86/28/16/602862816.db2.gz	CYMWAOCGXGOUQP-UHFFFAOYSA-N	-2	1	393.440	2.954	20	0		GFADML
C[C@@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)oc3c2)cc1	ZINC000825448310	603402343	/nfs/dbraw/zinc/40/23/43/603402343.db2.gz	CLGQFAHWMVSHDG-SECBINFHSA-N	-2	1	377.378	2.663	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@H]2CCC[C@H]2CNC(=O)[O-])c([O-])c1	ZINC000823827976	603910288	/nfs/dbraw/zinc/91/02/88/603910288.db2.gz	NFCJDMZGTNCPMS-FZMZJTMJSA-N	-2	1	393.440	2.905	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)c([O-])c1	ZINC000832833699	603933604	/nfs/dbraw/zinc/93/36/04/603933604.db2.gz	QVFXQUBSBSEDFQ-UHFFFAOYSA-N	-2	1	384.367	2.779	20	0		GFADML
CC(C)n1ncc2cc([N-]S(=O)(=O)c3ccc(F)cc3C(=O)[O-])cnc21	ZINC000833514053	604744863	/nfs/dbraw/zinc/74/48/63/604744863.db2.gz	NTJCVUPCGDBXLH-UHFFFAOYSA-N	-2	1	378.385	2.650	20	0		GFADML
CC(=O)Nc1ccc([O-])c(C(=O)Nc2ccc(OCC(=O)[O-])c(Cl)c2)c1	ZINC000825908276	604941820	/nfs/dbraw/zinc/94/18/20/604941820.db2.gz	VYVANAZJVJREBH-UHFFFAOYSA-N	-2	1	378.768	2.720	20	0		GFADML
CCS[C@H](C)c1noc(CN(C)C(=O)c2ccc(NC(=O)[O-])cc2[O-])n1	ZINC000827494837	605414556	/nfs/dbraw/zinc/41/45/56/605414556.db2.gz	DLWKTHHPGCRKDI-SECBINFHSA-N	-2	1	380.426	2.951	20	0		GFADML
Cn1ccnc1[C@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1ccc(F)cc1	ZINC000833956467	605627452	/nfs/dbraw/zinc/62/74/52/605627452.db2.gz	YOJDHHJYSSSXMK-MRXNPFEDSA-N	-2	1	384.367	2.874	20	0		GFADML
Cn1ccnc1[C@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1ccccc1F	ZINC000833954387	605627741	/nfs/dbraw/zinc/62/77/41/605627741.db2.gz	IGMGEWHONAQRFY-MRXNPFEDSA-N	-2	1	384.367	2.874	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)c([O-])c1	ZINC000834255857	605665945	/nfs/dbraw/zinc/66/59/45/605665945.db2.gz	IHFZXZAQJOHRRJ-IAQYHMDHSA-N	-2	1	378.331	2.708	20	0		GFADML
CS(=O)(=O)[N-]c1ccsc1C(=O)OCc1cc(C(=O)[O-])ccc1Cl	ZINC000833737548	605813617	/nfs/dbraw/zinc/81/36/17/605813617.db2.gz	GNGOLVIMNJQNOY-UHFFFAOYSA-N	-2	1	389.838	2.828	20	0		GFADML
CCCCCC[C@@](C)([N-]S(=O)(=O)c1cn(C)nc1C(F)(F)F)C(=O)[O-]	ZINC000829982904	660628385	/nfs/dbraw/zinc/62/83/85/660628385.db2.gz	IRHICRKERVYZIJ-CYBMUJFWSA-N	-2	1	385.408	2.531	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C[C@H]1C	ZINC000268199261	654963017	/nfs/dbraw/zinc/96/30/17/654963017.db2.gz	OIBQQNBUBUVLRN-VXGBXAGGSA-N	-2	1	380.491	2.983	20	0		GFADML
CCS(=O)(=O)[N-]c1cc(OC)ccc1S(=O)(=O)[N-]c1cccc(C)c1	ZINC000270463282	655045537	/nfs/dbraw/zinc/04/55/37/655045537.db2.gz	DSPIINMUSPEBET-UHFFFAOYSA-N	-2	1	384.479	2.566	20	0		GFADML
N#Cc1ccc(S(=O)(=O)[N-][N-]C(=O)c2c(Cl)cccc2Cl)c(F)c1	ZINC000158137140	655105250	/nfs/dbraw/zinc/10/52/50/655105250.db2.gz	GSLSPAUXRJCSDQ-UHFFFAOYSA-N	-2	1	388.207	2.627	20	0		GFADML
O=C([O-])c1c(Cl)cccc1[N-]S(=O)(=O)c1ccc2oc(=O)ccc2c1	ZINC000327432297	655386154	/nfs/dbraw/zinc/38/61/54/655386154.db2.gz	OVFQPFDULWUQLK-UHFFFAOYSA-N	-2	1	379.777	2.945	20	0		GFADML
CN(C)C(=O)Sc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)c1	ZINC000728508524	655556110	/nfs/dbraw/zinc/55/61/10/655556110.db2.gz	VULCUKAUXZERIP-UHFFFAOYSA-N	-2	1	380.447	2.959	20	0		GFADML
CC[C@H](C)C[C@@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000776616675	656768418	/nfs/dbraw/zinc/76/84/18/656768418.db2.gz	VOKSOOWSJKXTNQ-IONNQARKSA-N	-2	1	399.694	2.665	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)OC3)cc1C(=O)[O-]	ZINC000808125234	659878821	/nfs/dbraw/zinc/87/88/21/659878821.db2.gz	OTEKHZQCGVFONE-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
CC(C)OC[C@H]([N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C(=O)[O-]	ZINC000863416798	662328758	/nfs/dbraw/zinc/32/87/58/662328758.db2.gz	OCVVNQRCEINHGT-JTQLQIEISA-N	-2	1	389.779	2.515	20	0		GFADML
CCOc1cc(C(=O)N2C[C@H](C(=O)[O-])[C@@H](C(F)(F)F)C2)cc(Cl)c1[O-]	ZINC000910394180	664209617	/nfs/dbraw/zinc/20/96/17/664209617.db2.gz	MEZGLWOWBUFPHW-IUCAKERBSA-N	-2	1	381.734	2.779	20	0		GFADML
O=C(Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1)c1ccc(O)c(Cl)c1	ZINC000180057421	552211685	/nfs/dbraw/zinc/21/16/85/552211685.db2.gz	WRYLMCMRJORYCP-UHFFFAOYSA-N	-2	1	384.816	2.878	20	0		GFADML
Cc1csc([C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)C2CC2)n1	ZINC000185063517	552352829	/nfs/dbraw/zinc/35/28/29/552352829.db2.gz	CMIUUQHBOBWWOP-CYBMUJFWSA-N	-2	1	388.417	2.858	20	0		GFADML
CCc1ccc(S(=O)(=O)[N-]c2ccc(C(N)=O)c(Cl)c2)cc1C(=O)[O-]	ZINC000327430780	563457796	/nfs/dbraw/zinc/45/77/96/563457796.db2.gz	DMYJROUPSWIZAW-UHFFFAOYSA-N	-2	1	382.825	2.500	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(C)c(C(=O)[O-])s2)c1Cl	ZINC000431180944	563556057	/nfs/dbraw/zinc/55/60/57/563556057.db2.gz	REJIRRFJRHTUOY-UHFFFAOYSA-N	-2	1	389.838	2.996	20	0		GFADML
O=C(NC1(C(F)F)CC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436519341	563672722	/nfs/dbraw/zinc/67/27/22/563672722.db2.gz	WOTYLLNZHIPVHF-UHFFFAOYSA-N	-2	1	388.417	2.782	20	0		GFADML
C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(O)c3)cc(Cl)c2O1	ZINC000436773436	563679477	/nfs/dbraw/zinc/67/94/77/563679477.db2.gz	RNLOAEYHYJTVEL-MRVPVSSYSA-N	-2	1	383.809	2.868	20	0		GFADML
O=C(NC1(C2CC2)CC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000539884453	564231824	/nfs/dbraw/zinc/23/18/24/564231824.db2.gz	YJAINTBTNXSOSA-UHFFFAOYSA-N	-2	1	378.475	2.927	20	0		GFADML
Cc1nc(CCC[N-]S(=O)(=O)c2sccc2Cl)sc1C(=O)[O-]	ZINC000565936443	564302712	/nfs/dbraw/zinc/30/27/12/564302712.db2.gz	KTGCLKFXNAXFKI-UHFFFAOYSA-N	-2	1	380.900	2.776	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2C)cc1C(N)=O	ZINC000476417266	564339134	/nfs/dbraw/zinc/33/91/34/564339134.db2.gz	UGAVMEDQOAZECK-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2O)cc1C(=O)[O-]	ZINC000479273589	564434303	/nfs/dbraw/zinc/43/43/03/564434303.db2.gz	FJGKJKMZXQPUIJ-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])cc1C(=O)[O-]	ZINC000479276145	564434771	/nfs/dbraw/zinc/43/47/71/564434771.db2.gz	CLOIWFFAJHHSCY-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc(Cl)c1F	ZINC000480212493	564464319	/nfs/dbraw/zinc/46/43/19/564464319.db2.gz	YAKMKFAEDYTLGV-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)cc(Cl)c1F	ZINC000480219755	564465270	/nfs/dbraw/zinc/46/52/70/564465270.db2.gz	BWDNHEFBDMJMKE-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000547546575	564492323	/nfs/dbraw/zinc/49/23/23/564492323.db2.gz	FBDBZTYOTWEEJW-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
COc1ccc(Br)c(C(=O)[O-])c1[N-]S(=O)(=O)CCC(C)C	ZINC000547608283	564501734	/nfs/dbraw/zinc/50/17/34/564501734.db2.gz	AMVKVQMGUCDMDC-UHFFFAOYSA-N	-2	1	380.260	2.944	20	0		GFADML
CC(C)(C)[C@@H](C[N-]S(=O)(=O)c1sccc1Br)CC(=O)[O-]	ZINC000548214664	564537314	/nfs/dbraw/zinc/53/73/14/564537314.db2.gz	QMNJFTGMXFWGMP-MRVPVSSYSA-N	-2	1	384.317	2.926	20	0		GFADML
CC[C@](C)(C[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000548223645	564539367	/nfs/dbraw/zinc/53/93/67/564539367.db2.gz	OJEPPLRTXPKLSM-SNVBAGLBSA-N	-2	1	390.708	2.943	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2cc(F)c(F)c(F)c2)cc1F	ZINC000525482004	564702751	/nfs/dbraw/zinc/70/27/51/564702751.db2.gz	WJUPQKZWIMSPOW-UHFFFAOYSA-N	-2	1	379.287	2.507	20	0		GFADML
O=C([O-])[C@H](CCSc1ccccc1)[N-]S(=O)(=O)c1cc(F)ccc1F	ZINC000579656851	564750206	/nfs/dbraw/zinc/75/02/06/564750206.db2.gz	DSXOZKLSGVRNTJ-AWEZNQCLSA-N	-2	1	387.429	2.879	20	0		GFADML
COCc1cc(Cl)cc(S(=O)(=O)[N-]c2cc(OC)ccc2C(=O)[O-])c1	ZINC000580925727	564779696	/nfs/dbraw/zinc/77/96/96/564779696.db2.gz	WQHNNFKWECQNIH-UHFFFAOYSA-N	-2	1	385.825	2.994	20	0		GFADML
CCC(=O)C[C@@H]([N-]S(=O)(=O)c1sc2ccccc2c1Cl)C(=O)[O-]	ZINC000556702281	564836740	/nfs/dbraw/zinc/83/67/40/564836740.db2.gz	OWFBHQDMJBYCJU-SNVBAGLBSA-N	-2	1	375.855	2.655	20	0		GFADML
CCCC[C@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000462407888	564838076	/nfs/dbraw/zinc/83/80/76/564838076.db2.gz	FUCYSDHXAFFGPC-JTQLQIEISA-N	-2	1	386.214	2.649	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C[C@@H](C)C(=O)[O-])cc1	ZINC000558460129	564901859	/nfs/dbraw/zinc/90/18/59/564901859.db2.gz	ZQVOGYLHMDXVRQ-SECBINFHSA-N	-3	1	383.447	2.819	20	0		GFADML
C[C@@H](CSCC[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl)C(=O)[O-]	ZINC000592448452	565276858	/nfs/dbraw/zinc/27/68/58/565276858.db2.gz	DLZJCUSAHFKUDQ-ZETCQYMHSA-N	-2	1	390.285	2.865	20	0		GFADML
CCC1CCC([N-]S(=O)(=O)c2ncccc2C(F)(F)F)(C(=O)[O-])CC1	ZINC000646026726	565582668	/nfs/dbraw/zinc/58/26/68/565582668.db2.gz	ZSGZROMWOOCCKB-UHFFFAOYSA-N	-2	1	380.388	2.802	20	0		GFADML
Cc1[n-][nH]c(=O)c1NC(=O)c1cc(Br)c([O-])c(Br)c1	ZINC000647815843	565678044	/nfs/dbraw/zinc/67/80/44/565678044.db2.gz	NZGLKSSBDNQHNY-UHFFFAOYSA-N	-2	1	391.019	2.907	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ncccc1C(F)(F)F)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653492842	565969012	/nfs/dbraw/zinc/96/90/12/565969012.db2.gz	AQAXACAYLPEZIR-DVVUODLYSA-N	-2	1	380.388	2.514	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccccc2CC(=O)[O-])cc1[N+](=O)[O-]	ZINC000327348145	597312460	/nfs/dbraw/zinc/31/24/60/597312460.db2.gz	GMPAWYQYXCUPNR-UHFFFAOYSA-N	-2	1	384.797	2.985	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])cc1	ZINC000727795462	599765367	/nfs/dbraw/zinc/76/53/67/599765367.db2.gz	IJVPEYAUCPZCPX-UHFFFAOYSA-N	-2	1	381.381	2.892	20	0		GFADML
CC[C@@H](Cc1ccccc1)NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736906126	599767248	/nfs/dbraw/zinc/76/72/48/599767248.db2.gz	LULCPJMXUXAVIZ-KRWDZBQOSA-N	-2	1	393.443	2.544	20	0		GFADML
CCOCc1cccc(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000737177794	599819688	/nfs/dbraw/zinc/81/96/88/599819688.db2.gz	KUAONVLNAKGUMF-UHFFFAOYSA-N	-2	1	395.415	2.582	20	0		GFADML
COCCc1ccc(S(=O)(=O)[N-]c2cccc(CSCC(=O)[O-])c2)cc1	ZINC000737824444	599927432	/nfs/dbraw/zinc/92/74/32/599927432.db2.gz	VWOISKHCESXZJM-UHFFFAOYSA-N	-2	1	395.502	2.994	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](CCC(=O)[O-])c2ccccc2)c(F)c1	ZINC000681571760	599980665	/nfs/dbraw/zinc/98/06/65/599980665.db2.gz	SXAJRDKSKBARIA-HNNXBMFYSA-N	-2	1	385.388	2.858	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)Nc1ccc(CN(C)C(=O)[O-])cc1	ZINC000738875638	600306191	/nfs/dbraw/zinc/30/61/91/600306191.db2.gz	RMNPKWIOJAIDIS-UHFFFAOYSA-N	-2	1	397.435	2.733	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2NC(C)=O)cc1C(=O)[O-]	ZINC000058495148	600544101	/nfs/dbraw/zinc/54/41/01/600544101.db2.gz	ZUSJBDCEZCJUQG-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
C[C@@H]1CCC[C@@H](CCNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736775199	600622218	/nfs/dbraw/zinc/62/22/18/600622218.db2.gz	NBJQDMGKHROLLS-CABCVRRESA-N	-2	1	385.464	2.739	20	0		GFADML
Cc1cccc([C@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1C	ZINC000738689639	600623710	/nfs/dbraw/zinc/62/37/10/600623710.db2.gz	DSHMIRXRKRFYNM-HNNXBMFYSA-N	-2	1	393.443	2.901	20	0		GFADML
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cc(Cl)cc(C(=O)[O-])c1	ZINC000737947353	600637918	/nfs/dbraw/zinc/63/79/18/600637918.db2.gz	HOVLXGQGNKPEFP-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
O=C([O-])Nc1cc([N-]S(=O)(=O)c2ccc(N3CCOC3=O)cc2)ccc1F	ZINC000740012649	600694076	/nfs/dbraw/zinc/69/40/76/600694076.db2.gz	QDXCDUKXMVMSFT-UHFFFAOYSA-N	-2	1	395.368	2.673	20	0		GFADML
Cc1cccc([C@H](C)CNC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)c1	ZINC000738690506	600791264	/nfs/dbraw/zinc/79/12/64/600791264.db2.gz	LDMBCSYDKVPEEH-OAHLLOKOSA-N	-2	1	393.443	2.635	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])cs1)c1nc(-c2cccc(F)c2)no1	ZINC000827746815	600800738	/nfs/dbraw/zinc/80/07/38/600800738.db2.gz	GWSUOBWJENJVFY-MRVPVSSYSA-N	-2	1	397.409	2.675	20	0		GFADML
Cc1ccc(C(=O)N(C)C)cc1[N-]S(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1	ZINC000738503879	600889488	/nfs/dbraw/zinc/88/94/88/600889488.db2.gz	CEWJFPPJQPIHSI-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
Cc1cc(C(=O)NC(C)C)ccc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(C)c1	ZINC000506678099	600890256	/nfs/dbraw/zinc/89/02/56/600890256.db2.gz	ZQQYZCPFNRUMMW-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
CSc1cc2c(cc1[N-]S(=O)(=O)c1ccc(C(=O)[O-])c(C)c1)OCCO2	ZINC000506623588	600891430	/nfs/dbraw/zinc/89/14/30/600891430.db2.gz	KRLUPGAWUWSXMM-UHFFFAOYSA-N	-2	1	395.458	2.987	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2cccc3c2COC3=O)cc1	ZINC000736232145	600899470	/nfs/dbraw/zinc/89/94/70/600899470.db2.gz	GPOUWNHLNOTLGT-UHFFFAOYSA-N	-2	1	375.402	2.520	20	0		GFADML
COC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(C=CC(=O)[O-])cc2)ccc1F	ZINC000831206476	601328944	/nfs/dbraw/zinc/32/89/44/601328944.db2.gz	IDAMZZDDNOBHHL-RUDMXATFSA-N	-2	1	394.380	2.903	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)n(-c2ccncc2)n1	ZINC000832898460	601362064	/nfs/dbraw/zinc/36/20/64/601362064.db2.gz	LEGVYVPCGRLOOU-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2ccc(NC(C)=O)c(Cl)c2)c1	ZINC000481982340	601474734	/nfs/dbraw/zinc/47/47/34/601474734.db2.gz	QEBNPXJRZBVJJK-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
CC[C@](C)(CC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000828671483	601478870	/nfs/dbraw/zinc/47/88/70/601478870.db2.gz	DLPNOPAHFQLIBU-GFCCVEGCSA-N	-2	1	386.214	2.649	20	0		GFADML
CC[C@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(C)c2C)cc1)C(=O)[O-]	ZINC000262502819	601752825	/nfs/dbraw/zinc/75/28/25/601752825.db2.gz	NUGRNGALOYYLCR-INIZCTEOSA-N	-2	1	390.461	2.697	20	0		GFADML
CC[C@@H](NC(=O)c1cc(S(=O)(=O)[N-]c2ccccc2C)ccc1C)C(=O)[O-]	ZINC000262930013	601753338	/nfs/dbraw/zinc/75/33/38/601753338.db2.gz	GEVHPZLMUITQKC-MRXNPFEDSA-N	-2	1	390.461	2.697	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1nc(CCCC(=O)[O-])cs1	ZINC000830136811	601782308	/nfs/dbraw/zinc/78/23/08/601782308.db2.gz	JJWWUYDEYCSDMW-UHFFFAOYSA-N	-2	1	397.478	2.564	20	0		GFADML
Cn1cc(NS(=O)(=O)c2cc(Cl)c(Cl)c(C(=O)[O-])c2)cc1C(=O)[O-]	ZINC000833050997	601783783	/nfs/dbraw/zinc/78/37/83/601783783.db2.gz	PYKFUVSLAQGKOM-UHFFFAOYSA-N	-2	1	393.204	2.529	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(CC(=O)[O-])cc2)ccc1Cl	ZINC000762445617	601827625	/nfs/dbraw/zinc/82/76/25/601827625.db2.gz	WSPRUNHZRZTXKC-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)c(Cl)n1	ZINC000832413242	602106886	/nfs/dbraw/zinc/10/68/86/602106886.db2.gz	LWKLXAODLOSCIY-UHFFFAOYSA-N	-2	1	378.740	2.521	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)OCCNC(=O)[O-])c2)c1	ZINC000832973025	602257549	/nfs/dbraw/zinc/25/75/49/602257549.db2.gz	OCPJTMRMINYOBI-UHFFFAOYSA-N	-2	1	392.433	2.529	20	0		GFADML
COCc1cccc(S(=O)(=O)[N-]c2ccc3c(c2)CN(C(=O)[O-])CC3)c1	ZINC000739846985	602490992	/nfs/dbraw/zinc/49/09/92/602490992.db2.gz	QXALNBVMSDIBBT-UHFFFAOYSA-N	-2	1	376.434	2.670	20	0		GFADML
CN(CCCNC(=O)[O-])Cc1nc(=O)c2sc(-c3ccc(F)cc3)cc2[n-]1	ZINC000739679289	603252427	/nfs/dbraw/zinc/25/24/27/603252427.db2.gz	REPBZQNJTMSHGD-UHFFFAOYSA-N	-2	1	390.440	2.880	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)Nc1cccc(OCCNC(=O)[O-])c1	ZINC000830704882	603486810	/nfs/dbraw/zinc/48/68/10/603486810.db2.gz	RMSVUIOFBWYMJR-UHFFFAOYSA-N	-2	1	388.424	2.687	20	0		GFADML
CCN(CC1CCN(Cn2[n-]c(-c3ccccn3)nc2=S)CC1)C(=O)[O-]	ZINC000827099561	603601206	/nfs/dbraw/zinc/60/12/06/603601206.db2.gz	PZMUGFUJKWKZKV-UHFFFAOYSA-N	-2	1	376.486	2.672	20	0		GFADML
O=C([O-])N1CCc2c1cccc2[N-]S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000832080548	604016717	/nfs/dbraw/zinc/01/67/17/604016717.db2.gz	ZGNZFSIAVSEQKG-UHFFFAOYSA-N	-2	1	390.417	2.689	20	0		GFADML
COC(=O)[C@@H](c1cccc(C(=O)[O-])c1)N1CCC(C(=O)c2ccc([O-])cc2)CC1	ZINC000833700065	604481646	/nfs/dbraw/zinc/48/16/46/604481646.db2.gz	AINLYPULOGNGDL-LJQANCHMSA-N	-2	1	397.427	2.899	20	0		GFADML
O=C([O-])C[C@@H]1CCCN1C(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000262914709	604592702	/nfs/dbraw/zinc/59/27/02/604592702.db2.gz	JYBJSJAYFNEVRJ-INIZCTEOSA-N	-2	1	388.445	2.567	20	0		GFADML
CCOc1ccc([N-]S(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2OC)cc1	ZINC000833663541	604859123	/nfs/dbraw/zinc/85/91/23/604859123.db2.gz	WQWFLRRFNZGNNR-UHFFFAOYSA-N	-2	1	381.406	2.602	20	0		GFADML
CC(=O)N1CCc2cc([N-]S(=O)(=O)c3ccc(C(=O)[O-])c(Cl)c3)ccc21	ZINC000438815663	604990854	/nfs/dbraw/zinc/99/08/54/604990854.db2.gz	SYYGERRUPKFFFS-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cccc3c2ccnc3C(=O)[O-])cc1OC	ZINC000833733283	605150414	/nfs/dbraw/zinc/15/04/14/605150414.db2.gz	LEUXFAUHBWKTJV-UHFFFAOYSA-N	-2	1	388.401	2.751	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)cc1C(=O)[O-]	ZINC000753774660	605166930	/nfs/dbraw/zinc/16/69/30/605166930.db2.gz	MARRZNYZFRWALL-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
Cn1ccnc1C[C@@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1ccccc1	ZINC000833958235	605653111	/nfs/dbraw/zinc/65/31/11/605653111.db2.gz	VPCIOIRTHHVCRQ-MRXNPFEDSA-N	-2	1	380.404	2.929	20	0		GFADML
CS(C)(=O)=Nc1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000821106758	660315779	/nfs/dbraw/zinc/31/57/79/660315779.db2.gz	OSTKLRVPYZVTAI-UHFFFAOYSA-N	-2	1	386.426	2.684	20	0		GFADML
C[C@@H](Oc1cccc(Br)c1)C(=O)N[N-]C(=O)c1c([O-])cccc1F	ZINC000163812472	655136094	/nfs/dbraw/zinc/13/60/94/655136094.db2.gz	KOUHWKPVCZUGFH-SECBINFHSA-N	-2	1	397.200	2.522	20	0		GFADML
C[C@H](CCCC(=O)[O-])[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000274985996	655210157	/nfs/dbraw/zinc/21/01/57/655210157.db2.gz	MBNAUZHWEYRKKD-SSDOTTSWSA-N	-2	1	386.214	2.649	20	0		GFADML
C[C@@H](CCC[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000275049628	655213864	/nfs/dbraw/zinc/21/38/64/655213864.db2.gz	WTWMZSJRLZGRSU-ZETCQYMHSA-N	-2	1	386.214	2.507	20	0		GFADML
Cc1nc(CCC[N-]S(=O)(=O)c2c(F)cc(C)cc2F)sc1C(=O)[O-]	ZINC000575116580	655435955	/nfs/dbraw/zinc/43/59/55/655435955.db2.gz	FOVBAMRSCYIADJ-UHFFFAOYSA-N	-2	1	390.433	2.647	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])cc(C(=O)[O-])c1Cl	ZINC000759089347	655946862	/nfs/dbraw/zinc/94/68/62/655946862.db2.gz	KRLHCXCBXRACSP-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
O=C([O-])c1cc(F)ccc1[N-]S(=O)(=O)c1ccc2nc(Cl)cnc2c1	ZINC000759705430	655961513	/nfs/dbraw/zinc/96/15/13/655961513.db2.gz	IVBZKIRNVYTKLJ-UHFFFAOYSA-N	-2	1	381.772	2.921	20	0		GFADML
COC[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])c(F)cc1Cl)c1ccc(C)o1	ZINC000761309805	656010232	/nfs/dbraw/zinc/01/02/32/656010232.db2.gz	QOQSPYCNPFPSMZ-GFCCVEGCSA-N	-2	1	391.804	2.745	20	0		GFADML
Cc1cc(F)c(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(OC(F)F)nc1	ZINC000793433779	658396528	/nfs/dbraw/zinc/39/65/28/658396528.db2.gz	WMKXGEDKUWEVHC-UHFFFAOYSA-N	-2	1	376.312	2.630	20	0		GFADML
CS(=O)(=O)[N-]c1cc(F)ccc1NC(=O)c1cc(C(=O)[O-])ccc1Cl	ZINC000811822772	660015974	/nfs/dbraw/zinc/01/59/74/660015974.db2.gz	KUAJVPPNWVNYQJ-UHFFFAOYSA-N	-2	1	386.788	2.801	20	0		GFADML
Cc1ccc(CN2CCC[C@H]([N-]C(=O)C(F)(F)F)[C@@H]2C(=O)[O-])c(Cl)c1	ZINC000852733677	661872620	/nfs/dbraw/zinc/87/26/20/661872620.db2.gz	WDCWMZKWKYEXQM-QWHCGFSZSA-N	-2	1	378.778	2.745	20	0		GFADML
O=C([O-])C1=CC[C@H]([N-]S(=O)(=O)c2cc(Br)sc2Cl)C1	ZINC000853069382	661880571	/nfs/dbraw/zinc/88/05/71/661880571.db2.gz	ORQIDMLLBGMWPP-LURJTMIESA-N	-2	1	386.676	2.616	20	0		GFADML
O=S(=O)([N-]c1cnn(CC2CC2)c1)c1c([O-])cccc1OC(F)(F)F	ZINC000901895740	663749939	/nfs/dbraw/zinc/74/99/39/663749939.db2.gz	ZCWFNHMXNJOXTG-UHFFFAOYSA-N	-2	1	377.344	2.698	20	0		GFADML
Cc1noc(C(C)(C)[N-]S(=O)(=O)c2cc(C(=O)[O-])c(Cl)cc2Cl)n1	ZINC000283807078	563455185	/nfs/dbraw/zinc/45/51/85/563455185.db2.gz	BDAVZAGYMSWKTE-UHFFFAOYSA-N	-2	1	394.236	2.597	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(F)F)c(F)c2)cc1	ZINC000392287466	563526039	/nfs/dbraw/zinc/52/60/39/563526039.db2.gz	YAEUZGCVKOZHCF-UHFFFAOYSA-N	-2	1	375.324	2.855	20	0		GFADML
O=C([O-])Cc1cccc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2O)c1	ZINC000436479285	563672147	/nfs/dbraw/zinc/67/21/47/563672147.db2.gz	UUQSWKZHLAECCJ-UHFFFAOYSA-N	-2	1	375.324	2.839	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2O)cc1C(=O)[O-]	ZINC000436955220	563686890	/nfs/dbraw/zinc/68/68/90/563686890.db2.gz	JOMTXYWTPBULGK-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)CC3)cc1Cl	ZINC000438778506	563710433	/nfs/dbraw/zinc/71/04/33/563710433.db2.gz	MBWLVALJUVLVOQ-UHFFFAOYSA-N	-2	1	380.809	2.724	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(F)c(F)c(F)c2)cc1CC(=O)[O-]	ZINC000538090374	564182666	/nfs/dbraw/zinc/18/26/66/564182666.db2.gz	UMSLQNBKBRLDPT-UHFFFAOYSA-N	-2	1	375.324	2.540	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1cc(F)cc(C(=O)[O-])c1	ZINC000475737900	564317387	/nfs/dbraw/zinc/31/73/87/564317387.db2.gz	GATVPXAYXZXYAC-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CC[C@@H](CC[N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-]	ZINC000568363373	564415444	/nfs/dbraw/zinc/41/54/44/564415444.db2.gz	DCAPKTXGSITMJV-ZETCQYMHSA-N	-2	1	386.214	2.507	20	0		GFADML
CC1([C@H]([N-]S(=O)(=O)c2ccc(Br)o2)C(=O)[O-])CCCCC1	ZINC000548357717	564550106	/nfs/dbraw/zinc/55/01/06/564550106.db2.gz	AQZPJAXFNHKFJY-LLVKDONJSA-N	-2	1	380.260	2.744	20	0		GFADML
Cc1cccc(S(=O)(=O)[N-]c2cc(Br)cc(C(=O)[O-])c2N)c1	ZINC000549718986	564603333	/nfs/dbraw/zinc/60/33/33/564603333.db2.gz	KQTBXQVEUNKWCH-UHFFFAOYSA-N	-2	1	385.239	2.839	20	0		GFADML
O=C([O-])[C@@H](CC(F)F)[N-]S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F	ZINC000551996417	564671856	/nfs/dbraw/zinc/67/18/56/564671856.db2.gz	NRRSHUUTFRNVNQ-SSDOTTSWSA-N	-2	1	381.706	2.746	20	0		GFADML
Cc1ncsc1[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000527051647	564728383	/nfs/dbraw/zinc/72/83/83/564728383.db2.gz	AHXNLXNGEAXXQF-ZETCQYMHSA-N	-2	1	387.291	2.924	20	0		GFADML
O=C([O-])[C@H](Cc1ccco1)[N-]S(=O)(=O)c1ccc(Cl)c(F)c1Cl	ZINC000530541151	564887487	/nfs/dbraw/zinc/88/74/87/564887487.db2.gz	HTTZTQFQWBCWGZ-VIFPVBQESA-N	-2	1	382.196	2.700	20	0		GFADML
Cc1cc(C(=O)NCc2cccc(Cl)c2Cl)[n-]c2nc(=O)[n-]c(=O)c1-2	ZINC000531051019	564899854	/nfs/dbraw/zinc/89/98/54/564899854.db2.gz	KIGWDGYKDUZQMQ-UHFFFAOYSA-N	-2	1	379.203	2.981	20	0		GFADML
CC1(C)C[C@H]([N-]S(=O)(=O)c2csnc2C(=O)[O-])c2cc(F)ccc2O1	ZINC000650443488	565822715	/nfs/dbraw/zinc/82/27/15/565822715.db2.gz	CQAWORJPLSCHNG-JTQLQIEISA-N	-2	1	386.426	2.561	20	0		GFADML
CC1(C)CCC[C@]([N-]S(=O)(=O)c2ncccc2C(F)(F)F)(C(=O)[O-])C1	ZINC000629335137	565845052	/nfs/dbraw/zinc/84/50/52/565845052.db2.gz	LQVDHHQAOXLTFP-CQSZACIVSA-N	-2	1	380.388	2.802	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2C(=O)[O-])c1C	ZINC000609984778	566060558	/nfs/dbraw/zinc/06/05/58/566060558.db2.gz	DEDLNPSGTRNIJK-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=c1c2c([n-]n1-c1ccc(S(=O)(=O)[N-]c3nccs3)cc1)CCCC2	ZINC000634617783	566161962	/nfs/dbraw/zinc/16/19/62/566161962.db2.gz	XWJSDMIFGJLOIY-ZDUSSCGKSA-N	-2	1	376.463	2.837	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2CC(=O)[O-])cc1Cl	ZINC000817715943	597485831	/nfs/dbraw/zinc/48/58/31/597485831.db2.gz	PNSNSSGAMQSIPT-UHFFFAOYSA-N	-2	1	382.825	2.726	20	0		GFADML
CC(=O)Nc1ccc(C)cc1[N-]S(=O)(=O)c1ccc(OCCC(=O)[O-])cc1	ZINC000736161793	599747564	/nfs/dbraw/zinc/74/75/64/599747564.db2.gz	ISEZDFAKIJXVMW-UHFFFAOYSA-N	-2	1	392.433	2.608	20	0		GFADML
CCCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(CC(=O)[O-])cc2)cc1	ZINC000737030084	599765535	/nfs/dbraw/zinc/76/55/35/599765535.db2.gz	PQGRSGSAXKYSBT-UHFFFAOYSA-N	-2	1	377.418	2.681	20	0		GFADML
COC(=O)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cc(F)ccc1Cl	ZINC000737717272	599801772	/nfs/dbraw/zinc/80/17/72/599801772.db2.gz	KNMMLSOGONRMBV-UHFFFAOYSA-N	-2	1	393.801	2.826	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1C(=O)NC(C)C	ZINC000517476945	599908262	/nfs/dbraw/zinc/90/82/62/599908262.db2.gz	MZDXGJIXNWQDTL-UHFFFAOYSA-N	-2	1	376.434	2.632	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2cccc(CSCC(=O)[O-])c2)cc1	ZINC000736166063	599926432	/nfs/dbraw/zinc/92/64/32/599926432.db2.gz	UUMPHDLLFFVKPD-UHFFFAOYSA-N	-2	1	394.474	2.764	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)NC(C)(C)C(=O)[O-])c2)c1	ZINC000262494756	599985850	/nfs/dbraw/zinc/98/58/50/599985850.db2.gz	XGUMDSMEMXYMOK-UHFFFAOYSA-N	-2	1	390.461	2.697	20	0		GFADML
CC1=C(C(=O)[O-])[C@H](c2ccc([O-])c(Cl)c2)NC(=O)N1CCCCC(=O)[O-]	ZINC000736752847	599988954	/nfs/dbraw/zinc/98/89/54/599988954.db2.gz	YRMWRUQETDTBGP-HNNXBMFYSA-N	-3	1	382.800	2.725	20	0		GFADML
CCOCCOc1ccc(S(=O)(=O)[N-]c2cc(OC)ccc2C(=O)[O-])cc1	ZINC000516370500	600006032	/nfs/dbraw/zinc/00/60/32/600006032.db2.gz	CZLQAOIPVHHKKG-UHFFFAOYSA-N	-2	1	395.433	2.610	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1cccc(NC(=O)C2CC2)c1	ZINC000740143621	600097296	/nfs/dbraw/zinc/09/72/96/600097296.db2.gz	IBVCHWCEHOFCSJ-UHFFFAOYSA-N	-2	1	378.381	2.673	20	0		GFADML
CCN(C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)[C@H]1CCCC[C@@H]1C	ZINC000737059041	600121143	/nfs/dbraw/zinc/12/11/43/600121143.db2.gz	ZGCCNNZREBAFNX-KSSFIOAISA-N	-2	1	385.464	2.834	20	0		GFADML
COc1cc(F)c([N-]S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)cc1OC	ZINC000737888605	600236439	/nfs/dbraw/zinc/23/64/39/600236439.db2.gz	FXYNFVXEMSFGMN-UHFFFAOYSA-N	-2	1	391.323	2.620	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)N3CCCC4(CCCCC4)C3)cc2)[n-]1	ZINC000739878127	600281156	/nfs/dbraw/zinc/28/11/56/600281156.db2.gz	YATKQUIHMDNUGP-UHFFFAOYSA-N	-2	1	397.475	2.979	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)cc1	ZINC000736166201	600300062	/nfs/dbraw/zinc/30/00/62/600300062.db2.gz	YMOMUFSYAOCQLQ-UHFFFAOYSA-N	-2	1	377.422	2.556	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)ccc1OC	ZINC000610057574	600545060	/nfs/dbraw/zinc/54/50/60/600545060.db2.gz	LQLLAZLKCWVIST-UHFFFAOYSA-N	-2	1	399.808	2.634	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1sccc1Br)c1ccccc1	ZINC000061609458	600775319	/nfs/dbraw/zinc/77/53/19/600775319.db2.gz	UKIMPQQHDVBUOR-SNVBAGLBSA-N	-2	1	390.280	2.657	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1N1CCOC1=O	ZINC000746056823	600867796	/nfs/dbraw/zinc/86/77/96/600867796.db2.gz	ZQFCVMWPDWHMTP-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(N3CCCCC3)nc2)ccc1C(=O)[O-]	ZINC000832904618	600978820	/nfs/dbraw/zinc/97/88/20/600978820.db2.gz	WBHLOFUSCFHWLB-UHFFFAOYSA-N	-2	1	375.450	2.879	20	0		GFADML
Cc1oc(S(=O)(=O)[N-]N=c2[nH]cc(C(F)(F)F)cc2Cl)cc1C(=O)[O-]	ZINC000833027094	601231372	/nfs/dbraw/zinc/23/13/72/601231372.db2.gz	OYNWFFVHAHVNKP-UHFFFAOYSA-N	-2	1	399.734	2.659	20	0		GFADML
COC(=O)/C=C/c1ccc(S(=O)(=O)[N-]c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000747605209	601320490	/nfs/dbraw/zinc/32/04/90/601320490.db2.gz	XZJAQMSZWXJWPC-RUDMXATFSA-N	-2	1	379.365	2.511	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1F	ZINC000831779150	601326608	/nfs/dbraw/zinc/32/66/08/601326608.db2.gz	CKXMVRZXCWGBCJ-RUDMXATFSA-N	-2	1	395.408	2.750	20	0		GFADML
Cc1nccn1-c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cn1	ZINC000832868175	601360270	/nfs/dbraw/zinc/36/02/70/601360270.db2.gz	GYSKWTJUXITEFC-UHFFFAOYSA-N	-2	1	386.433	2.692	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1F)c1nc(C2CCCCC2)no1	ZINC000827746947	601385067	/nfs/dbraw/zinc/38/50/67/601385067.db2.gz	IDAGMDLFGPEFQQ-SNVBAGLBSA-N	-2	1	397.428	2.994	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(NC(C)=O)c(Cl)c2)c(C(=O)[O-])c1	ZINC000504651908	601474823	/nfs/dbraw/zinc/47/48/23/601474823.db2.gz	YJNAJTCXUYFNEP-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(C)c(C(=O)[O-])c1	ZINC000443364783	601575662	/nfs/dbraw/zinc/57/56/62/601575662.db2.gz	BCTFZBIBIBVLPK-UHFFFAOYSA-N	-2	1	393.417	2.981	20	0		GFADML
CCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000326886046	601828379	/nfs/dbraw/zinc/82/83/79/601828379.db2.gz	HORQGJYIENBOGD-UHFFFAOYSA-N	-2	1	382.825	2.589	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc3oc(=O)ccc3c2)ccc1Cl	ZINC000833306018	601829314	/nfs/dbraw/zinc/82/93/14/601829314.db2.gz	KACNKAGAUHLALR-UHFFFAOYSA-N	-2	1	379.777	2.945	20	0		GFADML
COc1cc(C)c([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1OC	ZINC000751142064	601831109	/nfs/dbraw/zinc/83/11/09/601831109.db2.gz	KYJGUTNJPFSFJF-UHFFFAOYSA-N	-2	1	387.360	2.789	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])c(Cl)cc1F	ZINC000057819632	601837266	/nfs/dbraw/zinc/83/72/66/601837266.db2.gz	GBMDJQABISHBQM-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
Cc1nccn1-c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cn1	ZINC000833009054	601843761	/nfs/dbraw/zinc/84/37/61/601843761.db2.gz	KJADYJCAFDWFAP-UHFFFAOYSA-N	-2	1	392.824	2.728	20	0		GFADML
CC(C)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Br)[nH]n1	ZINC000317838322	601850529	/nfs/dbraw/zinc/85/05/29/601850529.db2.gz	KJMJKBLPBHZTQN-UHFFFAOYSA-N	-2	1	388.243	2.795	20	0		GFADML
Cc1ccnc(Br)c1[N-]S(=O)(=O)c1cc(C(=O)[O-])cs1	ZINC000832983113	602213912	/nfs/dbraw/zinc/21/39/12/602213912.db2.gz	JATCLRCVSQNWIS-UHFFFAOYSA-N	-2	1	377.241	2.713	20	0		GFADML
Cc1ccn(-c2ccccc2[N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)n1	ZINC000759172773	602309565	/nfs/dbraw/zinc/30/95/65/602309565.db2.gz	ZBQZRBZVZYHASX-UHFFFAOYSA-N	-2	1	375.381	2.819	20	0		GFADML
CC(C)c1ccc([C@H](CNC(=O)c2nc3ccccc3c(=O)[n-]2)NC(=O)[O-])cc1	ZINC000738882606	602391537	/nfs/dbraw/zinc/39/15/37/602391537.db2.gz	MNMJUZWJAMHOPR-KRWDZBQOSA-N	-2	1	394.431	2.785	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)CN(C(=O)[O-])CC2	ZINC000740107861	602490830	/nfs/dbraw/zinc/49/08/30/602490830.db2.gz	RCAXZGKOJUZHPZ-UHFFFAOYSA-N	-3	1	390.417	2.530	20	0		GFADML
O=C([O-])NCc1cccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)c1	ZINC000740680539	602656373	/nfs/dbraw/zinc/65/63/73/602656373.db2.gz	TXTNGKXLZDTKMD-UHFFFAOYSA-N	-2	1	389.433	2.530	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCC[C@H](CNC(=O)[O-])C2)c([O-])c1	ZINC000738722251	602854124	/nfs/dbraw/zinc/85/41/24/602854124.db2.gz	CECSLRSXXVGXER-GFCCVEGCSA-N	-2	1	393.440	2.859	20	0		GFADML
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738707671	602862365	/nfs/dbraw/zinc/86/23/65/602862365.db2.gz	KOHVZTWXWLRNQI-GFCCVEGCSA-N	-2	1	393.440	2.859	20	0		GFADML
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738710033	602864880	/nfs/dbraw/zinc/86/48/80/602864880.db2.gz	RWBBVXCXWMFODC-LBPRGKRZSA-N	-2	1	379.413	2.611	20	0		GFADML
Cc1ccc(NC(=O)C[C@H](C)NC(=O)[O-])cc1[N-]S(=O)(=O)c1ccccc1	ZINC000830363021	603332483	/nfs/dbraw/zinc/33/24/83/603332483.db2.gz	COHZBOZAFKHBFT-ZDUSSCGKSA-N	-2	1	391.449	2.781	20	0		GFADML
CCC(CC)(C[N-]S(=O)(=O)c1sccc1Br)NC(=O)[O-]	ZINC000826561217	603476415	/nfs/dbraw/zinc/47/64/15/603476415.db2.gz	OWYWTVAZEWAQRI-UHFFFAOYSA-N	-2	1	385.305	2.615	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)Oc2cccc(NC(=O)[O-])c2)o1	ZINC000823778567	603481170	/nfs/dbraw/zinc/48/11/70/603481170.db2.gz	FOAABSHXLSNXQD-UHFFFAOYSA-N	-2	1	382.394	2.666	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N[C@@H](CNC(=O)[O-])C1CCCCC1	ZINC000830704362	603490520	/nfs/dbraw/zinc/49/05/20/603490520.db2.gz	MZZQFQSQKVPZML-ZDUSSCGKSA-N	-2	1	378.473	2.734	20	0		GFADML
O=C([O-])Nc1cc2c(cc1[N-]S(=O)(=O)c1ccc3c(c1)CCC3)OCO2	ZINC000832828657	603889453	/nfs/dbraw/zinc/88/94/53/603889453.db2.gz	JUWORPJNLSRYNS-UHFFFAOYSA-N	-2	1	376.390	2.795	20	0		GFADML
CCc1cc2c(COC(=O)C[C@H]3CCCN3C(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000827568427	603948642	/nfs/dbraw/zinc/94/86/42/603948642.db2.gz	ARFOIOGVLXAMSI-CYBMUJFWSA-N	-2	1	375.377	2.637	20	0		GFADML
CSc1nc(C)c(CCC(=O)O[C@@H](C)[C@H]2CCCCN2C(=O)[O-])c(=O)[n-]1	ZINC000829777716	604120109	/nfs/dbraw/zinc/12/01/09/604120109.db2.gz	LEMKXNHXFGBYSW-WCQYABFASA-N	-2	1	383.470	2.609	20	0		GFADML
Cc1ccc(-c2nc(C(=O)[N-]c3nnc(CCC(=O)[O-])s3)cs2)n1C	ZINC000833746410	604755391	/nfs/dbraw/zinc/75/53/91/604755391.db2.gz	DTRILJBMCCIXAM-UHFFFAOYSA-N	-2	1	377.451	2.578	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(N(C)C)c(C)c2)c(OC)c1C(=O)[O-]	ZINC000833734560	604861947	/nfs/dbraw/zinc/86/19/47/604861947.db2.gz	MUWKJXQGXKTRSD-UHFFFAOYSA-N	-2	1	394.449	2.577	20	0		GFADML
Cc1c(C(=O)[O-])csc1NS(=O)(=O)c1ccc(C(=O)[O-])cc1Cl	ZINC000833741481	605127268	/nfs/dbraw/zinc/12/72/68/605127268.db2.gz	OQJBAOZCMJGJBA-UHFFFAOYSA-N	-2	1	375.811	2.907	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cccc3c2ccnc3C(=O)[O-])ccc1C(=O)[O-]	ZINC000833746979	605151931	/nfs/dbraw/zinc/15/19/31/605151931.db2.gz	MXCCRXKHJSWJNQ-UHFFFAOYSA-N	-3	1	386.385	2.740	20	0		GFADML
O=C([O-])c1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(C(=O)NC2CC2)cc1	ZINC000833766494	605169852	/nfs/dbraw/zinc/16/98/52/605169852.db2.gz	SSDMEGHETGHDES-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
CC(C)CCOc1ccc(S(=O)(=O)[N-]c2ncc(-c3nn[n-]n3)s2)cc1	ZINC000820076953	607025210	/nfs/dbraw/zinc/02/52/10/607025210.db2.gz	WWDQRKBFJVENTM-UHFFFAOYSA-N	-2	1	394.482	2.549	20	0		GFADML
Cc1c(Cl)cccc1S(=O)(=O)[N-]NC(=O)c1ccc(Cl)cc1[O-]	ZINC000055664840	654779806	/nfs/dbraw/zinc/77/98/06/654779806.db2.gz	JTGZAVZELJMPKV-UHFFFAOYSA-N	-2	1	375.233	2.631	20	0		GFADML
COC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)cc1	ZINC000729666391	655566538	/nfs/dbraw/zinc/56/65/38/655566538.db2.gz	UVNUVFINZAGDGT-UHFFFAOYSA-N	-2	1	384.435	2.758	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(O)c2)c1Cl	ZINC000753778153	655858516	/nfs/dbraw/zinc/85/85/16/655858516.db2.gz	CBBQHVOMFWOYKW-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
O=C([O-])c1cc2c(cc1[N-]S(=O)(=O)c1ccc3ncsc3c1)OCO2	ZINC000776443744	656741905	/nfs/dbraw/zinc/74/19/05/656741905.db2.gz	UYNLAVPLJPHIJU-UHFFFAOYSA-N	-2	1	378.387	2.524	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2cccc3c2COC3=O)cc1C(=O)[O-]	ZINC000808128232	659879539	/nfs/dbraw/zinc/87/95/39/659879539.db2.gz	LFWHKFKGWVGYBM-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]C(C)(C)CCC(=O)[O-])c(F)cc1Cl	ZINC000841777511	661312553	/nfs/dbraw/zinc/31/25/53/661312553.db2.gz	GOTWMSDQUGMBMK-UHFFFAOYSA-N	-2	1	395.836	2.578	20	0		GFADML
O=C([O-])C1=CC[C@H]([N-]S(=O)(=O)c2cc(Cl)c(Br)cc2F)C1	ZINC000853068810	661880457	/nfs/dbraw/zinc/88/04/57/661880457.db2.gz	FHLJJNWUKCBRAI-ZETCQYMHSA-N	-2	1	398.637	2.693	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@@H]([N-]S(=O)(=O)c1sccc1Cl)CCS2	ZINC000899949411	663703832	/nfs/dbraw/zinc/70/38/32/663703832.db2.gz	OLWYKNYXIIOONT-JVVWGOMOSA-N	-2	1	381.928	2.809	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-][C@@H]2CCCC2(F)F)c(Br)s1	ZINC000398077052	677411864	/nfs/dbraw/zinc/41/18/64/677411864.db2.gz	DVLFQEWQOHKTHL-SSDOTTSWSA-N	-2	1	390.227	2.675	20	0		GFADML
Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(F)cc2[N-]S(C)(=O)=O)c(C)c1	ZINC000179764623	552202532	/nfs/dbraw/zinc/20/25/32/552202532.db2.gz	LYHKPVXUEWRZJT-UHFFFAOYSA-N	-2	1	386.470	2.923	20	0		GFADML
CCN(CC(F)F)C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000184649607	552341106	/nfs/dbraw/zinc/34/11/06/552341106.db2.gz	IWWDVVACNPQPHP-UHFFFAOYSA-N	-2	1	390.433	2.982	20	0		GFADML
C[C@H]([C@@H]([N-]S(=O)(=O)c1cc(Br)c(F)cc1F)C(=O)[O-])C1CC1	ZINC000515872321	564489271	/nfs/dbraw/zinc/48/92/71/564489271.db2.gz	YSEDXTBYSZYBLC-PWCHPLFNSA-N	-2	1	398.225	2.505	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)[C@H]1CCOC2(CCC2)C1	ZINC000372262905	563300690	/nfs/dbraw/zinc/30/06/90/563300690.db2.gz	TWCLRHBIHIONSJ-GWCFXTLKSA-N	-2	1	391.848	2.560	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(OC[C@H]3CCCO3)cc2)cs1	ZINC000298856544	563368730	/nfs/dbraw/zinc/36/87/30/563368730.db2.gz	NPZCZKNAVSWCPO-CYBMUJFWSA-N	-2	1	383.447	2.805	20	0		GFADML
O=C([O-])C1([N-]S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)CCOCC1	ZINC000316598634	563441501	/nfs/dbraw/zinc/44/15/01/563441501.db2.gz	GYJDGFQNOUAMAM-UHFFFAOYSA-N	-2	1	388.656	2.559	20	0		GFADML
O=C([O-])[C@H]([N-]S(=O)(=O)c1c(F)cc(F)cc1F)c1ccccc1Cl	ZINC000326258132	563454637	/nfs/dbraw/zinc/45/46/37/563454637.db2.gz	QKYPASYKABZEIN-GFCCVEGCSA-N	-2	1	379.743	2.862	20	0		GFADML
CCNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000327706028	563459257	/nfs/dbraw/zinc/45/92/57/563459257.db2.gz	YSOWPCYTQOVBNK-UHFFFAOYSA-N	-2	1	382.825	2.589	20	0		GFADML
COc1ccc(C(=O)[O-])c([N-]S(=O)(=O)c2ccc(Br)cc2)c1	ZINC000388434055	563520557	/nfs/dbraw/zinc/52/05/57/563520557.db2.gz	CVJWJBRITAWJST-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
COC(=O)c1cccc(F)c1[N-]S(=O)(=O)c1ccc(C(=O)[O-])cc1Cl	ZINC000436197966	563667812	/nfs/dbraw/zinc/66/78/12/563667812.db2.gz	LPESIQAVEPQVCQ-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)cc1O	ZINC000436945654	563686099	/nfs/dbraw/zinc/68/60/99/563686099.db2.gz	BFARAMKHYBGKMM-UHFFFAOYSA-N	-2	1	375.324	2.996	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(NC(N)=O)c1	ZINC000476272428	564333105	/nfs/dbraw/zinc/33/31/05/564333105.db2.gz	BLTOIIAISXXKPI-UHFFFAOYSA-N	-2	1	383.813	2.638	20	0		GFADML
CC1(F)CC(NC(=O)c2ccc([N-]S(=O)(=O)c3cccs3)cc2[O-])C1	ZINC000452277060	564402458	/nfs/dbraw/zinc/40/24/58/564402458.db2.gz	MJIFOUQMYJBESN-UHFFFAOYSA-N	-2	1	384.454	2.875	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccccc2C[S@@](C)=O)c(C)c1C(=O)[O-]	ZINC000545122722	564408985	/nfs/dbraw/zinc/40/89/85/564408985.db2.gz	BSILVGYEKHWLOB-XMMPIXPASA-N	-2	1	381.475	2.681	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2ccc([S@](C)=O)cc2)cc1C(=O)[O-]	ZINC000479244007	564432720	/nfs/dbraw/zinc/43/27/20/564432720.db2.gz	BMJVQPOJELKKQU-QHCPKHFHSA-N	-2	1	387.866	2.885	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccccc2C[S@](C)=O)c1C	ZINC000569283799	564457059	/nfs/dbraw/zinc/45/70/59/564457059.db2.gz	PQAFSDAFRCWWHX-DEOSSOPVSA-N	-2	1	381.475	2.681	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(CC(=O)[O-])cc2)c1	ZINC000546537250	564458501	/nfs/dbraw/zinc/45/85/01/564458501.db2.gz	OGLQGZHEXCARAB-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
Cc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2[O-])cc1Br	ZINC000481455667	564512679	/nfs/dbraw/zinc/51/26/79/564512679.db2.gz	WPVFAYQIIGNTHT-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
O=C([O-])[C@H](CC(F)F)[N-]S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1	ZINC000547878525	564515313	/nfs/dbraw/zinc/51/53/13/564515313.db2.gz	PSYPAFHIKGYSFX-VIFPVBQESA-N	-2	1	396.824	2.850	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])cc1Cl	ZINC000481967673	564529990	/nfs/dbraw/zinc/52/99/90/564529990.db2.gz	XPYSIHHGKJMOLL-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1cc(C(=O)[O-])sc1C	ZINC000519217660	564572561	/nfs/dbraw/zinc/57/25/61/564572561.db2.gz	SVKDJBHMQQUACM-UHFFFAOYSA-N	-2	1	387.460	2.976	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cc(F)ccc1F)Cc1cccc(Cl)c1	ZINC000573629291	564647418	/nfs/dbraw/zinc/64/74/18/564647418.db2.gz	DSJPDBHKCXFMBG-NSHDSACASA-N	-2	1	389.807	2.840	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2C)c1	ZINC000525533311	564702317	/nfs/dbraw/zinc/70/23/17/564702317.db2.gz	YJVFRGPKHGHDCT-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
CCc1oc(C(=O)OC)cc1S(=O)(=O)[N-]c1c(Cl)cccc1C(=O)[O-]	ZINC000614314354	565107157	/nfs/dbraw/zinc/10/71/57/565107157.db2.gz	DABGHYGFMLTJJC-UHFFFAOYSA-N	-2	1	387.797	2.781	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2c(O)cccc2F)cc1Br	ZINC000673884475	565851209	/nfs/dbraw/zinc/85/12/09/565851209.db2.gz	AHHFSJHGTHXGEH-UHFFFAOYSA-N	-2	1	390.186	2.793	20	0		GFADML
COc1ccc(-c2nc(SCCCSC)[n-]c(=O)c2-c2nnn[n-]2)cc1	ZINC000821731574	599381865	/nfs/dbraw/zinc/38/18/65/599381865.db2.gz	DYIQVSZGKDQUQU-UHFFFAOYSA-N	-2	1	390.494	2.883	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)Nc1ccc(CCC(=O)[O-])cc1	ZINC000738364276	599772921	/nfs/dbraw/zinc/77/29/21/599772921.db2.gz	CZIKLOMJAXXBOD-UHFFFAOYSA-N	-2	1	382.420	2.640	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1Cl)c1nc(C2CC2)no1	ZINC000736389183	599775085	/nfs/dbraw/zinc/77/50/85/599775085.db2.gz	FSKGJYNYZYFEBI-CYBMUJFWSA-N	-2	1	399.856	2.974	20	0		GFADML
O=C([O-])CSCc1cccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000739874200	599926993	/nfs/dbraw/zinc/92/69/93/599926993.db2.gz	OMFMFPJCQHNUIV-UHFFFAOYSA-N	-3	1	399.421	2.643	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](CCC(=O)[O-])c2ccccc2)c(F)c1	ZINC000681571761	599980499	/nfs/dbraw/zinc/98/04/99/599980499.db2.gz	SXAJRDKSKBARIA-OAHLLOKOSA-N	-2	1	385.388	2.858	20	0		GFADML
O=C([O-])[C@H](CNC(=O)c1ccc(Br)cc1[O-])Cc1cccc(F)c1	ZINC000739409223	599984128	/nfs/dbraw/zinc/98/41/28/599984128.db2.gz	UIHYNHBQJGNFFT-NSHDSACASA-N	-2	1	396.212	2.967	20	0		GFADML
O=C([O-])c1cccc([N-]S(=O)(=O)c2ccc(NC(=O)c3ccncc3)cc2)c1	ZINC000591079603	600002936	/nfs/dbraw/zinc/00/29/36/600002936.db2.gz	VVUKAFHJTPKGLR-UHFFFAOYSA-N	-2	1	397.412	2.833	20	0		GFADML
CCOC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000737145326	600097649	/nfs/dbraw/zinc/09/76/49/600097649.db2.gz	XAKRNZSUSZOYDU-UHFFFAOYSA-N	-2	1	396.396	2.917	20	0		GFADML
O=C([O-])[C@H]1C[C@@H]1C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1	ZINC000739552644	600102766	/nfs/dbraw/zinc/10/27/66/600102766.db2.gz	JHMMTRLKBVMQRO-GJZGRUSLSA-N	-2	1	394.836	2.800	20	0		GFADML
COc1ccc(C(=O)[N-]C(=O)CSc2nc3ccc(C(=O)[O-])cc3o2)cc1	ZINC000737922009	600276744	/nfs/dbraw/zinc/27/67/44/600276744.db2.gz	FJZNJZZMQMLLKU-UHFFFAOYSA-N	-2	1	386.385	2.583	20	0		GFADML
CC(=O)N1CCc2cc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(Cl)c3)ccc21	ZINC000057177940	600482544	/nfs/dbraw/zinc/48/25/44/600482544.db2.gz	DHFAJBBBANDWQS-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
CC(C)S(=O)(=O)Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)c1	ZINC000487372187	600488512	/nfs/dbraw/zinc/48/85/12/600488512.db2.gz	NNOLXJPBILYHGC-UHFFFAOYSA-N	-2	1	397.474	2.509	20	0		GFADML
CC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(OCCCC(=O)[O-])cc2)c1	ZINC000736196107	600488571	/nfs/dbraw/zinc/48/85/71/600488571.db2.gz	IGHLWIFCARZRPL-UHFFFAOYSA-N	-2	1	377.418	2.934	20	0		GFADML
Cc1nc2cc(F)cc(C(=O)[N-]c3nnc(CCCC(=O)[O-])s3)c2nc1C	ZINC000738873039	600536057	/nfs/dbraw/zinc/53/60/57/600536057.db2.gz	NKOPCXDYOUEMET-UHFFFAOYSA-N	-2	1	389.412	2.897	20	0		GFADML
O=C([O-])c1ccnc([N-]S(=O)(=O)/C=C\c2cccc(Br)c2)c1	ZINC000740248920	600577166	/nfs/dbraw/zinc/57/71/66/600577166.db2.gz	LRZTXQZEESSBPS-ALCCZGGFSA-N	-2	1	383.223	2.955	20	0		GFADML
CCOCCCN(C[C@@H](C)C(=O)[O-])C(=O)c1ccc(Br)cc1[O-]	ZINC000737168636	600578637	/nfs/dbraw/zinc/57/86/37/600578637.db2.gz	QGUAQZUUMWSYIM-LLVKDONJSA-N	-2	1	388.258	2.744	20	0		GFADML
CSc1cc2c(cc1[N-]S(=O)(=O)c1ccc(CC(=O)[O-])cc1)OCCO2	ZINC000481977365	600628494	/nfs/dbraw/zinc/62/84/94/600628494.db2.gz	NEXXYOPNZGCLIV-UHFFFAOYSA-N	-2	1	395.458	2.608	20	0		GFADML
C[C@H]1Cc2cc(S(=O)(=O)[N-]c3cccc(OCC(=O)[O-])c3)cc(Cl)c2O1	ZINC000736825487	600635285	/nfs/dbraw/zinc/63/52/85/600635285.db2.gz	MPQNCEGKJWOBRF-JTQLQIEISA-N	-2	1	397.836	2.928	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(C(=O)NC3CC3)cc2)c1	ZINC000740076486	600888892	/nfs/dbraw/zinc/88/88/92/600888892.db2.gz	ZRMYLELUIYFMON-UHFFFAOYSA-N	-2	1	394.836	2.731	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737123973	600889574	/nfs/dbraw/zinc/88/95/74/600889574.db2.gz	PJDNOCSOUSONEG-UHFFFAOYSA-N	-2	1	396.852	2.897	20	0		GFADML
COC(=O)c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)c1	ZINC000737654919	600893347	/nfs/dbraw/zinc/89/33/47/600893347.db2.gz	ZKQGQDSHRFWTBN-UHFFFAOYSA-N	-2	1	397.836	2.945	20	0		GFADML
C[S@@](=O)Cc1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000738179694	600894963	/nfs/dbraw/zinc/89/49/63/600894963.db2.gz	MDPULZPUEWVTHD-HSZRJFAPSA-N	-2	1	387.866	2.718	20	0		GFADML
COC(=O)C(C)(C)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1	ZINC000525534819	600899908	/nfs/dbraw/zinc/89/99/08/600899908.db2.gz	SLGROOBZVSSMKA-UHFFFAOYSA-N	-2	1	377.418	2.636	20	0		GFADML
Cn1ccc2ccc(NC(=O)c3ccc(-n4[n-]c(CC(=O)[O-])cc4=O)cc3)cc21	ZINC000833055891	601061210	/nfs/dbraw/zinc/06/12/10/601061210.db2.gz	LKEWTVDCJOGYRZ-UHFFFAOYSA-N	-2	1	390.399	2.537	20	0		GFADML
CO[C@@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])c(Cl)cc1Cl)C(F)(F)F	ZINC000831519725	601244723	/nfs/dbraw/zinc/24/47/23/601244723.db2.gz	QMVHFMAAXUMUKR-VIFPVBQESA-N	-2	1	396.170	2.547	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)NC[C@@H](Cc1cccc(F)c1)C(=O)[O-]	ZINC000431653549	601283102	/nfs/dbraw/zinc/28/31/02/601283102.db2.gz	KVEVUVODCQFZQG-CYBMUJFWSA-N	-2	1	389.427	2.601	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000067124424	601327041	/nfs/dbraw/zinc/32/70/41/601327041.db2.gz	FZONFGDPGMASKP-UHFFFAOYSA-N	-2	1	391.449	2.944	20	0		GFADML
Cc1nc(-c2ccc([N-]S(=O)(=O)c3cc(C(=O)[O-])cc(C)c3C)cc2)n[nH]1	ZINC000622760228	601328368	/nfs/dbraw/zinc/32/83/68/601328368.db2.gz	VDGMPDAJGOXODR-UHFFFAOYSA-N	-2	1	386.433	2.896	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1	ZINC000552394257	601330129	/nfs/dbraw/zinc/33/01/29/601330129.db2.gz	JEZJJQHDVSYBKL-UHFFFAOYSA-N	-2	1	391.445	2.908	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cc(C(=O)[O-])ccc1OC(C)C	ZINC000443376085	601575598	/nfs/dbraw/zinc/57/55/98/601575598.db2.gz	QALIPXNWOZTOAV-UHFFFAOYSA-N	-2	1	393.417	2.979	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1NS(=O)(=O)c1ccsc1C(=O)[O-]	ZINC000832933591	601629723	/nfs/dbraw/zinc/62/97/23/601629723.db2.gz	ALKUCEJKZLKJHV-UHFFFAOYSA-N	-2	1	375.811	2.907	20	0		GFADML
Cc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)NCC(C)(C)C(=O)[O-])cc1	ZINC000262259689	601713783	/nfs/dbraw/zinc/71/37/83/601713783.db2.gz	SAKSLOLACGXVNS-UHFFFAOYSA-N	-2	1	390.461	2.636	20	0		GFADML
CC[C@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(C)c2)cc1)C(=O)[O-]	ZINC000647259440	601749109	/nfs/dbraw/zinc/74/91/09/601749109.db2.gz	VYNAAXSLHNGNOV-KRWDZBQOSA-N	-2	1	390.461	2.697	20	0		GFADML
CC[C@@H](NC(=O)c1cccc([N-]S(=O)(=O)c2cc(F)ccc2C)c1)C(=O)[O-]	ZINC000828976414	601761837	/nfs/dbraw/zinc/76/18/37/601761837.db2.gz	OJCFKWTVYSAMNY-OAHLLOKOSA-N	-2	1	394.424	2.528	20	0		GFADML
CN1C(=O)CCc2cc([N-]S(=O)(=O)c3ccc(Cl)c(C(=O)[O-])c3)ccc21	ZINC000729667118	601828286	/nfs/dbraw/zinc/82/82/86/601828286.db2.gz	NCYUWWDNGVIWHU-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
Cc1cccc(C(=O)[O-])c1NS(=O)(=O)c1cc(C(=O)[O-])c(F)cc1Cl	ZINC000063877578	601834244	/nfs/dbraw/zinc/83/42/44/601834244.db2.gz	CEFDPRNDOWZQET-UHFFFAOYSA-N	-2	1	387.772	2.985	20	0		GFADML
O=C([O-])c1nscc1S(=O)(=O)[N-]c1ccc(F)cc1Br	ZINC000833344854	601836218	/nfs/dbraw/zinc/83/62/18/601836218.db2.gz	DXZSIPSRAILAHM-UHFFFAOYSA-N	-2	1	381.204	2.544	20	0		GFADML
Cc1nc(-c2ccc([N-]S(=O)(=O)c3cc(F)c(F)c(C(=O)[O-])c3)cc2)n[nH]1	ZINC000751145941	601839451	/nfs/dbraw/zinc/83/94/51/601839451.db2.gz	NAXXFHIJNIGWFJ-UHFFFAOYSA-N	-2	1	394.359	2.557	20	0		GFADML
CCOC(=O)/C=C/c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000829837759	601855986	/nfs/dbraw/zinc/85/59/86/601855986.db2.gz	MDMCGJAIFLXTEM-DHZHZOJOSA-N	-2	1	393.392	2.901	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccc(NC(=O)[O-])nc1	ZINC000739376079	602036538	/nfs/dbraw/zinc/03/65/38/602036538.db2.gz	KFRCQDHSASJGRY-UHFFFAOYSA-N	-2	1	378.410	2.576	20	0		GFADML
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(F)c3)cc2C[C@H]1C	ZINC000533628160	602321962	/nfs/dbraw/zinc/32/19/62/602321962.db2.gz	IJCMCJMLMXGDJT-SNVBAGLBSA-N	-2	1	392.408	2.622	20	0		GFADML
CC(=O)N1CCCc2cc(S(=O)(=O)[N-]c3ccccc3NC(=O)[O-])ccc21	ZINC000738523579	602651892	/nfs/dbraw/zinc/65/18/92/602651892.db2.gz	LNDUPIAPBFCACM-UHFFFAOYSA-N	-2	1	389.433	2.876	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2cc(NC(=O)[O-])ccc2F)c(F)c1	ZINC000738571495	602652663	/nfs/dbraw/zinc/65/26/63/602652663.db2.gz	HCKROBVISLXMCW-UHFFFAOYSA-N	-2	1	385.348	2.814	20	0		GFADML
CCc1cc2c(COC(=O)[C@H]3CCC[C@@H]3NC(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000739542637	603127559	/nfs/dbraw/zinc/12/75/59/603127559.db2.gz	LGTZGMMJLYJMND-JSGCOSHPSA-N	-2	1	375.377	2.541	20	0		GFADML
Cc1nc(C(C)(C)C)[n-]c(=O)c1C(=O)N1CCC[C@@H]([C@H]2CCCN2C(=O)[O-])C1	ZINC000830705162	603481368	/nfs/dbraw/zinc/48/13/68/603481368.db2.gz	XMORWJHJKUEFJB-ZIAGYGMSSA-N	-2	1	390.484	2.783	20	0		GFADML
CCc1cc2c(COC(=O)C[C@@H]3CCCN3C(=O)[O-])cc(=O)oc2cc1[O-]	ZINC000827568428	603948692	/nfs/dbraw/zinc/94/86/92/603948692.db2.gz	ARFOIOGVLXAMSI-ZDUSSCGKSA-N	-2	1	375.377	2.637	20	0		GFADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])cc1	ZINC000831815575	604015405	/nfs/dbraw/zinc/01/54/05/604015405.db2.gz	NRDVEEBICGEULR-UHFFFAOYSA-N	-3	1	390.417	2.545	20	0		GFADML
Cc1cc([C@H](C)OC(=O)CCc2c(C)nc3cc(=O)[n-]n3c2C)oc1C(=O)[O-]	ZINC000832873026	604577283	/nfs/dbraw/zinc/57/72/83/604577283.db2.gz	YZXNGFHZOPCKEE-LBPRGKRZSA-N	-2	1	387.392	2.888	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC[C@@H](c3nnc4ccccn43)C2)c([O-])c1	ZINC000832828982	604769796	/nfs/dbraw/zinc/76/97/96/604769796.db2.gz	NVWUIDCPNDMARF-GFCCVEGCSA-N	-2	1	381.392	2.545	20	0		GFADML
CN(Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)N(C)CCC2)C(=O)[O-]	ZINC000828400375	604828880	/nfs/dbraw/zinc/82/88/80/604828880.db2.gz	ZBAZLUXMOAKJOV-UHFFFAOYSA-N	-2	1	389.477	2.980	20	0		GFADML
CC(C)c1cccnc1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000833511440	605116564	/nfs/dbraw/zinc/11/65/64/605116564.db2.gz	SAISUOZNRGIPOH-UHFFFAOYSA-N	-2	1	380.404	2.563	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)c1ccc(C2(C(=O)[O-])CC2)cc1	ZINC000833669426	605124793	/nfs/dbraw/zinc/12/47/93/605124793.db2.gz	FEEZOKXOVCIMKE-UHFFFAOYSA-N	-3	1	389.429	2.864	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2ccc(C)cc2C(=O)[O-])c1	ZINC000833657448	605185289	/nfs/dbraw/zinc/18/52/89/605185289.db2.gz	NUTBXRQHOXPZSD-UHFFFAOYSA-N	-2	1	376.434	2.552	20	0		GFADML
Cn1ccnc1C[C@H](NC(=O)c1ccc(NC(=O)[O-])cc1[O-])c1ccccc1	ZINC000833958233	605653282	/nfs/dbraw/zinc/65/32/82/605653282.db2.gz	VPCIOIRTHHVCRQ-INIZCTEOSA-N	-2	1	380.404	2.929	20	0		GFADML
CCCCCOc1ccc(S(=O)(=O)[N-]c2ncc(-c3nn[n-]n3)s2)cc1	ZINC000821060660	607025732	/nfs/dbraw/zinc/02/57/32/607025732.db2.gz	HFSGFUANFTTZML-UHFFFAOYSA-N	-2	1	394.482	2.693	20	0		GFADML
O=C([N-][N-]S(=O)(=O)c1c(Cl)cccc1Cl)NCCc1cccs1	ZINC000064940582	654877771	/nfs/dbraw/zinc/87/77/71/654877771.db2.gz	TYKGVYDVKBLZOV-UHFFFAOYSA-N	-2	1	394.305	2.790	20	0		GFADML
Cc1cc(S(=O)(=O)[N-][C@H](CC(F)(F)F)C(=O)[O-])sc1Br	ZINC000275326140	655229649	/nfs/dbraw/zinc/22/96/49/655229649.db2.gz	SXGDIPXTCSCHEK-RXMQYKEDSA-N	-2	1	396.206	2.503	20	0		GFADML
O=C([O-])[C@@H](O)[C@@H](CC1CCCCC1)[N-]S(=O)(=O)c1cc(Cl)ccc1F	ZINC000578017290	655471283	/nfs/dbraw/zinc/47/12/83/655471283.db2.gz	XJTRSKKBIHPJTJ-HIFRSBDPSA-N	-2	1	393.864	2.542	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc(C[S@](C)=O)c2)cc(C(=O)[O-])c1F	ZINC000763287110	656078451	/nfs/dbraw/zinc/07/84/51/656078451.db2.gz	NEYXORUMVHDTMY-DEOSSOPVSA-N	-2	1	385.438	2.512	20	0		GFADML
CSc1ccc(CC[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)cc1	ZINC000797816552	659053430	/nfs/dbraw/zinc/05/34/30/659053430.db2.gz	QQRFWZOMUWKTKH-UHFFFAOYSA-N	-2	1	387.429	2.906	20	0		GFADML
Cc1ccc(CN2CCC[C@@H]([N-]C(=O)C(F)(F)F)[C@H]2C(=O)[O-])c(Cl)c1	ZINC000852733676	661872501	/nfs/dbraw/zinc/87/25/01/661872501.db2.gz	WDCWMZKWKYEXQM-OLZOCXBDSA-N	-2	1	378.778	2.745	20	0		GFADML
CCS(=O)(=O)c1ccc([N-]S(=O)(=O)c2cccc(Cl)c2[O-])cc1	ZINC000583270052	450599493	/nfs/dbraw/zinc/59/94/93/450599493.db2.gz	RLBCIUNFNBMDIR-UHFFFAOYSA-N	-2	1	375.855	2.640	20	0		GFADML
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000436718680	563677627	/nfs/dbraw/zinc/67/76/27/563677627.db2.gz	FTBXFZQFAMWIAL-UHFFFAOYSA-N	-2	1	385.781	2.551	20	0		GFADML
CN(C)C(=O)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000442313853	563770824	/nfs/dbraw/zinc/77/08/24/563770824.db2.gz	GRRZVEXEPSVBDR-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
Cc1nc(=NCc2ccc(S(=O)(=O)[N-]c3ccc(F)cc3)cc2)s[n-]1	ZINC000474782216	564289111	/nfs/dbraw/zinc/28/91/11/564289111.db2.gz	XNDVRMQDVQNZBH-UHFFFAOYSA-N	-2	1	378.454	2.820	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2C)ccc1C(N)=O	ZINC000476388015	564336938	/nfs/dbraw/zinc/33/69/38/564336938.db2.gz	BVTXJEOFDJEAQJ-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cc(F)ccc1F)Cc1ccc(Cl)cc1	ZINC000547881878	564516306	/nfs/dbraw/zinc/51/63/06/564516306.db2.gz	GNYXHJBNSRRJIP-NSHDSACASA-N	-2	1	389.807	2.840	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cccc(F)c1F)Cc1ccc(Cl)cc1	ZINC000548203370	564535909	/nfs/dbraw/zinc/53/59/09/564535909.db2.gz	KKBDPPWUUUDOIW-NSHDSACASA-N	-2	1	389.807	2.840	20	0		GFADML
C[C@H]1CC[C@@](C[N-]S(=O)(=O)c2ccc(Br)o2)(CC(=O)[O-])C1	ZINC000548547318	564558928	/nfs/dbraw/zinc/55/89/28/564558928.db2.gz	CISIXVHYHQCYHS-ZANVPECISA-N	-2	1	380.260	2.602	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1cc(F)cc(C(=O)[O-])c1	ZINC000485304737	564611649	/nfs/dbraw/zinc/61/16/49/564611649.db2.gz	ZVZWGQAPFRUXFQ-UHFFFAOYSA-N	-2	1	385.394	2.745	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc([C@H]2CCC(=O)N2)c1	ZINC000573085413	564622638	/nfs/dbraw/zinc/62/26/38/564622638.db2.gz	FOPYFWDLXSJKCO-GFCCVEGCSA-N	-2	1	380.447	2.507	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)[N-]CC[C@H](CC(=O)[O-])C(F)(F)F)cc1F	ZINC000573113884	564623309	/nfs/dbraw/zinc/62/33/09/564623309.db2.gz	UGUMBIQYYNRUIP-MRVPVSSYSA-N	-2	1	375.315	2.595	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)c1C	ZINC000521280279	564623720	/nfs/dbraw/zinc/62/37/20/564623720.db2.gz	QLROULUFTISUBP-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COc1cc(F)c([N-]S(=O)(=O)c2cc(C)c(C(=O)[O-])s2)cc1OC	ZINC000521676432	564634171	/nfs/dbraw/zinc/63/41/71/564634171.db2.gz	HSAQQZJBXGZTBE-UHFFFAOYSA-N	-2	1	375.399	2.712	20	0		GFADML
Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(F)(F)F	ZINC000551997467	564672413	/nfs/dbraw/zinc/67/24/13/564672413.db2.gz	IZPGWHZUPPRALA-QMMMGPOBSA-N	-2	1	383.319	2.812	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1c(Cl)cccc1Cl)C(F)(F)F	ZINC000560421059	564961014	/nfs/dbraw/zinc/96/10/14/564961014.db2.gz	XCEHIEBWQMJREX-ZCFIWIBFSA-N	-2	1	380.171	2.925	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2c(C)c(Cl)ccc2C(=O)[O-])cc1C(N)=O	ZINC000618761894	565314088	/nfs/dbraw/zinc/31/40/88/565314088.db2.gz	TWGUKLMKXMLTLR-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C([O-])CC[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ncccc1C(F)(F)F	ZINC000650420703	565820517	/nfs/dbraw/zinc/82/05/17/565820517.db2.gz	KUXPOGNJABPTOZ-PWSUYJOCSA-N	-2	1	380.388	2.802	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2ccsc2)c(F)c1	ZINC000681558583	566112016	/nfs/dbraw/zinc/11/20/16/566112016.db2.gz	RVMATALBNXISMU-GFCCVEGCSA-N	-2	1	377.390	2.529	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](C(=O)[O-])c2ccccc2Cl)c(F)c1	ZINC000684561394	566238909	/nfs/dbraw/zinc/23/89/09/566238909.db2.gz	AWJHWLWBHZXKQW-CYBMUJFWSA-N	-2	1	391.779	2.731	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C)cc(S(C)(=O)=O)c2C)c(C(=O)[O-])c1	ZINC000592712944	600057090	/nfs/dbraw/zinc/05/70/90/600057090.db2.gz	NDTMPIYIWFDFPK-UHFFFAOYSA-N	-2	1	397.474	2.514	20	0		GFADML
CC(C)CC(CC(C)C)NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736404232	600077013	/nfs/dbraw/zinc/07/70/13/600077013.db2.gz	WCJVVMWLDHFGNF-UHFFFAOYSA-N	-2	1	387.480	2.983	20	0		GFADML
CC(C)NC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000736477026	600094062	/nfs/dbraw/zinc/09/40/62/600094062.db2.gz	ZMIOKFWZYFYRBY-UHFFFAOYSA-N	-2	1	395.412	2.855	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]C[C@H](Cc2cccc(C)c2)C(=O)[O-])c(F)c1	ZINC000681580001	600096960	/nfs/dbraw/zinc/09/69/60/600096960.db2.gz	CTZYEHKFVMKDDF-ZDUSSCGKSA-N	-2	1	399.415	2.504	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(C)[nH]c2C(=O)[O-])cc1Br	ZINC000317438522	600176020	/nfs/dbraw/zinc/17/60/20/600176020.db2.gz	XNTBGMCTYMFEEI-UHFFFAOYSA-N	-2	1	389.227	2.593	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(-c3nccc(C)n3)cc2)cc1C(=O)[O-]	ZINC000604305351	600545097	/nfs/dbraw/zinc/54/50/97/600545097.db2.gz	QOJMCPOMIPKAJC-UHFFFAOYSA-N	-2	1	399.428	2.960	20	0		GFADML
CCOCCCN(C[C@H](C)C(=O)[O-])C(=O)c1ccc(Br)cc1[O-]	ZINC000737168637	600578416	/nfs/dbraw/zinc/57/84/16/600578416.db2.gz	QGUAQZUUMWSYIM-NSHDSACASA-N	-2	1	388.258	2.744	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1Cl)c1nc(C(C)(C)C)no1	ZINC000827746614	600800683	/nfs/dbraw/zinc/80/06/83/600800683.db2.gz	FHGZACKXDWUEKM-MRVPVSSYSA-N	-2	1	387.845	2.758	20	0		GFADML
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1ccc(C)c(C(=O)[O-])c1	ZINC000013278907	600808342	/nfs/dbraw/zinc/80/83/42/600808342.db2.gz	BSKVCOMXGKMFPA-UHFFFAOYSA-N	-3	1	381.431	2.914	20	0		GFADML
CCNC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737122292	600887114	/nfs/dbraw/zinc/88/71/14/600887114.db2.gz	GYFHERXTEGGHMZ-UHFFFAOYSA-N	-2	1	382.825	2.589	20	0		GFADML
CNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737544221	600888358	/nfs/dbraw/zinc/88/83/58/600888358.db2.gz	AHLSRHWQKYIARM-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cc1NC(C)=O	ZINC000738041851	600888392	/nfs/dbraw/zinc/88/83/92/600888392.db2.gz	NMYVMZYMQUREFL-UHFFFAOYSA-N	-2	1	398.824	2.806	20	0		GFADML
CCn1cnnc1-c1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)c1	ZINC000506672837	600888761	/nfs/dbraw/zinc/88/87/61/600888761.db2.gz	FEFHFHGOSYHZRY-UHFFFAOYSA-N	-2	1	386.433	2.772	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2cccc(N3CCOC3=O)c2)c1	ZINC000740075309	600888844	/nfs/dbraw/zinc/88/88/44/600888844.db2.gz	JHEFLRCMHYQJEP-UHFFFAOYSA-N	-2	1	396.808	2.796	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(OCC(F)(F)F)nc2)ccc1C(=O)[O-]	ZINC000506689484	600888939	/nfs/dbraw/zinc/88/89/39/600888939.db2.gz	NIWWEVQPEPSMAY-UHFFFAOYSA-N	-2	1	390.339	2.830	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)[O-])c2)cc1C	ZINC000737701096	600891999	/nfs/dbraw/zinc/89/19/99/600891999.db2.gz	BWAUJTRLYXLXJQ-UHFFFAOYSA-N	-2	1	382.369	2.811	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@H](C(=O)[O-])c1ccccc1F	ZINC000829545783	601114863	/nfs/dbraw/zinc/11/48/63/601114863.db2.gz	MDMNUQRGQDWYJK-INIZCTEOSA-N	-2	1	395.408	2.960	20	0		GFADML
COC(=O)c1cc(C)c(C)c(S(=O)(=O)[N-]c2cccc(NC(=O)[O-])c2)c1	ZINC000831249326	601324768	/nfs/dbraw/zinc/32/47/68/601324768.db2.gz	XLYPYEMIKPRYTE-UHFFFAOYSA-N	-2	1	378.406	2.981	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(Cl)c2C)c(C(=O)[O-])c1	ZINC000832413272	601327933	/nfs/dbraw/zinc/32/79/33/601327933.db2.gz	NLKLCJADGQNYDD-UHFFFAOYSA-N	-3	1	399.808	2.854	20	0		GFADML
O=C([O-])CCOc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)CCC3)cc1	ZINC000833239456	601388815	/nfs/dbraw/zinc/38/88/15/601388815.db2.gz	IHMACAHXRDQGPF-UHFFFAOYSA-N	-2	1	389.429	2.860	20	0		GFADML
CC[C@@H](NC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1)C(=O)[O-]	ZINC000828976431	601748983	/nfs/dbraw/zinc/74/89/83/601748983.db2.gz	PWAJKWFNJPVCKC-OAHLLOKOSA-N	-2	1	396.852	2.734	20	0		GFADML
CC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000743729279	601828844	/nfs/dbraw/zinc/82/88/44/601828844.db2.gz	CGQAPIFYXQKFKK-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(-n3cc[nH]c3=O)c2)ccc1Cl	ZINC000833306028	601829318	/nfs/dbraw/zinc/82/93/18/601829318.db2.gz	MVKCRVRAYYOYHN-UHFFFAOYSA-N	-2	1	393.808	2.730	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-c3cc[nH]n3)cc2)cc(F)c1F	ZINC000751145314	601837579	/nfs/dbraw/zinc/83/75/79/601837579.db2.gz	JJOQIQZKTQVDAT-UHFFFAOYSA-N	-2	1	379.344	2.854	20	0		GFADML
CCOC(=O)/C=C\c1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000829837760	601856159	/nfs/dbraw/zinc/85/61/59/601856159.db2.gz	MDMCGJAIFLXTEM-FLIBITNWSA-N	-2	1	393.392	2.901	20	0		GFADML
CC(C)NC(=O)Nc1ccc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])cc1	ZINC000826976415	601856364	/nfs/dbraw/zinc/85/63/64/601856364.db2.gz	WITMGOKEMOSGEU-UHFFFAOYSA-N	-2	1	395.412	2.855	20	0		GFADML
CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)OC)c2)[nH]n1	ZINC000829216254	601861700	/nfs/dbraw/zinc/86/17/00/601861700.db2.gz	LQOBJLPOLFGYPK-SNVBAGLBSA-N	-2	1	395.437	2.599	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2cc(-c3cc(F)cc(F)c3)n[nH]2)c1	ZINC000833334441	601929663	/nfs/dbraw/zinc/92/96/63/601929663.db2.gz	NWSDPSFFHCOTRJ-UHFFFAOYSA-N	-2	1	379.344	2.854	20	0		GFADML
COC(=O)Cc1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000831188939	601987400	/nfs/dbraw/zinc/98/74/00/601987400.db2.gz	LTAVANXYBSRKNU-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
Cc1csc([C@@H](C)[N-]S(=O)(=O)c2cc(C(=O)[O-])oc2Br)n1	ZINC000096742963	602152342	/nfs/dbraw/zinc/15/23/42/602152342.db2.gz	MQGUTQSLZYZMDM-ZCFIWIBFSA-N	-2	1	395.256	2.545	20	0		GFADML
O=C([O-])c1ccc(Cl)c(S(=O)(=O)Nc2ccc3c(c2)CCN3C(=O)[O-])c1	ZINC000740715240	602246686	/nfs/dbraw/zinc/24/66/86/602246686.db2.gz	BMBAAAALBDNYCB-UHFFFAOYSA-N	-2	1	396.808	2.880	20	0		GFADML
COC(=O)/C=C/c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(F)c2)cc1	ZINC000754758653	602321108	/nfs/dbraw/zinc/32/11/08/602321108.db2.gz	NFIWFCIFNYYOMT-RUDMXATFSA-N	-2	1	379.365	2.511	20	0		GFADML
O=C([O-])N1CCCc2cc([N-]S(=O)(=O)c3ccc4c(c3)C(=O)OC4)ccc21	ZINC000740731084	602647035	/nfs/dbraw/zinc/64/70/35/602647035.db2.gz	BOMKQBCXAFIPOV-UHFFFAOYSA-N	-2	1	388.401	2.588	20	0		GFADML
CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2cccc(CNC(=O)[O-])c2)cc1	ZINC000739208840	602656646	/nfs/dbraw/zinc/65/66/46/602656646.db2.gz	KVAVKMVJAKPFNK-UHFFFAOYSA-N	-2	1	377.422	2.604	20	0		GFADML
CN(C[C@@H]1CCN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1)C(=O)[O-]	ZINC000739658098	602860577	/nfs/dbraw/zinc/86/05/77/602860577.db2.gz	WDIFQVJNKCZEEY-LBPRGKRZSA-N	-2	1	393.440	2.811	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN(C(=O)[O-])C3)cc1	ZINC000739502561	603182084	/nfs/dbraw/zinc/18/20/84/603182084.db2.gz	CWYQXEAZZNVSEE-UHFFFAOYSA-N	-2	1	376.434	2.922	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc([C@H](C)NC(=O)[O-])cc2)cc1C	ZINC000828788242	603402945	/nfs/dbraw/zinc/40/29/45/603402945.db2.gz	DDLVEBXMLIKWSB-LBPRGKRZSA-N	-2	1	392.433	2.911	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc([C@@H](C)NC(=O)[O-])cc2)cc1OC	ZINC000829511172	603403092	/nfs/dbraw/zinc/40/30/92/603403092.db2.gz	VAGREMKMYRSAFD-LLVKDONJSA-N	-2	1	380.422	2.833	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc([C@H](C)NC(=O)[O-])cc1	ZINC000830234270	603404132	/nfs/dbraw/zinc/40/41/32/603404132.db2.gz	PUKXKHYNPYSIFE-NSHDSACASA-N	-3	1	378.406	2.823	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc3c2CCN3C(=O)[O-])cc1OC	ZINC000829510445	604014240	/nfs/dbraw/zinc/01/42/40/604014240.db2.gz	JGMYJTCLWLGAKK-UHFFFAOYSA-N	-2	1	378.406	2.545	20	0		GFADML
CC1(C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3ccccc3NC(=O)[O-])cc21	ZINC000825698161	604422725	/nfs/dbraw/zinc/42/27/25/604422725.db2.gz	WJJNHFBVWALSIW-UHFFFAOYSA-N	-2	1	375.406	2.807	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])cc(Cl)c1F	ZINC000767736625	604631708	/nfs/dbraw/zinc/63/17/08/604631708.db2.gz	LMRMOBVHNVHOEX-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)c1	ZINC000268966828	604632123	/nfs/dbraw/zinc/63/21/23/604632123.db2.gz	NACOSEPDSOUEAR-UHFFFAOYSA-N	-2	1	379.434	2.867	20	0		GFADML
CCC[C@@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2C)cc1)C(=O)[O-]	ZINC000262083599	605023470	/nfs/dbraw/zinc/02/34/70/605023470.db2.gz	BKHNIQDTKHBEAB-QGZVFWFLSA-N	-2	1	390.461	2.779	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(C)cc2C(=O)[O-])cc(OC)c1OC	ZINC000833730165	605183740	/nfs/dbraw/zinc/18/37/40/605183740.db2.gz	ZAHDHFOWOGDJFX-UHFFFAOYSA-N	-2	1	381.406	2.520	20	0		GFADML
O=C([O-])NCc1n[nH]c(-c2ccc(NC(=O)c3cccc(Cl)c3[O-])cc2)n1	ZINC000834247042	605996639	/nfs/dbraw/zinc/99/66/39/605996639.db2.gz	MWEMNSCGJDESEW-UHFFFAOYSA-N	-2	1	387.783	2.851	20	0		GFADML
O=C([O-])NCc1nc(-c2ccc(NC(=O)c3cccc(Cl)c3[O-])cc2)n[nH]1	ZINC000834247042	605996640	/nfs/dbraw/zinc/99/66/40/605996640.db2.gz	MWEMNSCGJDESEW-UHFFFAOYSA-N	-2	1	387.783	2.851	20	0		GFADML
Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1nn(C(C)(C)C)cc1-c1nn[n-]n1	ZINC000822202423	606622360	/nfs/dbraw/zinc/62/23/60/606622360.db2.gz	ZBAAOOVFMLIQQU-UHFFFAOYSA-N	-2	1	395.876	2.581	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000047318155	654693075	/nfs/dbraw/zinc/69/30/75/654693075.db2.gz	HDSLRJLZNFQXCZ-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c([N+](=O)[O-])c2)cc1	ZINC000047906672	654701999	/nfs/dbraw/zinc/70/19/99/654701999.db2.gz	OLELCZWIQNYJPG-UHFFFAOYSA-N	-2	1	386.769	2.512	20	0		GFADML
CSc1ccc([N-]S(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)cc1	ZINC000057116664	654800904	/nfs/dbraw/zinc/80/09/04/654800904.db2.gz	FRYVNBCQLCUAIP-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
O=C(NCC(F)(F)F)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000097256411	655033801	/nfs/dbraw/zinc/03/38/01/655033801.db2.gz	MWVNUMIMGIHCQJ-UHFFFAOYSA-N	-2	1	380.369	2.547	20	0		GFADML
O=C([O-])c1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc2oc(=O)ccc2c1	ZINC000326754185	655385181	/nfs/dbraw/zinc/38/51/81/655385181.db2.gz	MOXUFVQPMAVMEZ-UHFFFAOYSA-N	-2	1	379.777	2.945	20	0		GFADML
COC(=O)c1ccc(F)c(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c1	ZINC000740700957	655698294	/nfs/dbraw/zinc/69/82/94/655698294.db2.gz	NWEHTOCLHPVYPA-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
COC[C@@H]([N-]S(=O)(=O)c1cc(Cl)c(F)c(C(=O)[O-])c1)c1ccc(C)o1	ZINC000761308208	656009885	/nfs/dbraw/zinc/00/98/85/656009885.db2.gz	FADGVNXOEBUEKP-GFCCVEGCSA-N	-2	1	391.804	2.745	20	0		GFADML
O=C(Nc1nc(Br)ccc1[O-])c1nn(-c2ccccc2)cc1[O-]	ZINC000783911019	657271724	/nfs/dbraw/zinc/27/17/24/657271724.db2.gz	UWGOYORZSRWABK-UHFFFAOYSA-N	-2	1	375.182	2.693	20	0		GFADML
O=C([O-])/C=C/C[N-]S(=O)(=O)c1cc(Br)c(Cl)cc1Cl	ZINC000788449278	657720446	/nfs/dbraw/zinc/72/04/46/657720446.db2.gz	XOMAZQMIYFNZQR-OWOJBTEDSA-N	-2	1	389.054	2.675	20	0		GFADML
CCC(C)(C)[C@H]([N-]S(=O)(=O)c1cc(Br)cnc1Cl)C(=O)[O-]	ZINC000843296489	661376528	/nfs/dbraw/zinc/37/65/28/661376528.db2.gz	MAZLWNKHSSPFDI-SECBINFHSA-N	-2	1	399.694	2.665	20	0		GFADML
Cc1cc(S(=O)(=O)[N-][C@H](C[C@H]2CCCO2)C(F)(F)F)sc1C(=O)[O-]	ZINC000871979729	662748794	/nfs/dbraw/zinc/74/87/94/662748794.db2.gz	SCRANXCFRMFUJM-RKDXNWHRSA-N	-2	1	387.401	2.533	20	0		GFADML
O=C([O-])CC1CC([N-]S(=O)(=O)c2cc(Br)sc2Cl)C1	ZINC000899933288	663703019	/nfs/dbraw/zinc/70/30/19/663703019.db2.gz	NXEXKRVHAVPMTN-UHFFFAOYSA-N	-2	1	388.692	2.696	20	0		GFADML
C[C@]1(C(=O)[O-])C[C@@H]([N-]S(=O)(=O)c2sc3ccccc3c2Cl)CCO1	ZINC000906011268	663908441	/nfs/dbraw/zinc/90/84/41/663908441.db2.gz	RHCXHZCCQAYVMJ-BJOHPYRUSA-N	-2	1	389.882	2.855	20	0		GFADML
C[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])C(F)(F)F	ZINC000436734565	563678684	/nfs/dbraw/zinc/67/86/84/563678684.db2.gz	ASTFYKYDVVAQRB-MRVPVSSYSA-N	-2	1	394.396	2.935	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])c(O)c1	ZINC000436775606	563679512	/nfs/dbraw/zinc/67/95/12/563679512.db2.gz	FWQUSPHLQMOEKE-UHFFFAOYSA-N	-3	1	385.781	2.551	20	0		GFADML
O=S(=O)([N-]c1cccc(S(=O)(=O)[N-]c2ccccc2)c1)c1ccco1	ZINC000437681453	563698380	/nfs/dbraw/zinc/69/83/80/563698380.db2.gz	KDGNGEQNNJSYTH-UHFFFAOYSA-N	-2	1	378.431	2.881	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2F)c(Cl)c1	ZINC000509664981	564309314	/nfs/dbraw/zinc/30/93/14/564309314.db2.gz	KUSRNOXZTBCEEG-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)CC(=O)N2	ZINC000476424829	564338681	/nfs/dbraw/zinc/33/86/81/564338681.db2.gz	SDDRRVFEFCBMAG-UHFFFAOYSA-N	-2	1	380.809	2.642	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc([S@@](C)=O)cc1	ZINC000476424776	564339171	/nfs/dbraw/zinc/33/91/71/564339171.db2.gz	HLGLRNCOOGJLQV-HSZRJFAPSA-N	-2	1	387.866	2.885	20	0		GFADML
COC(=O)c1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1F	ZINC000512751779	564410701	/nfs/dbraw/zinc/41/07/01/564410701.db2.gz	FDSPLDRHSDOHNQ-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
O=C([O-])c1cccc(Cl)c1[N-]S(=O)(=O)c1cnn(CC(F)(F)F)c1	ZINC000547544963	564492563	/nfs/dbraw/zinc/49/25/63/564492563.db2.gz	IAKGUXBKMDOGNG-UHFFFAOYSA-N	-2	1	383.735	2.598	20	0		GFADML
CCC[C@@H](O)[C@H]([N-]S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)C(=O)[O-]	ZINC000547613303	564503135	/nfs/dbraw/zinc/50/31/35/564503135.db2.gz	SZIGONFCQZQMAM-ZJUUUORDSA-N	-2	1	390.672	2.539	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2cccc(CC(=O)[O-])c2)cc1Cl	ZINC000481975769	564530573	/nfs/dbraw/zinc/53/05/73/564530573.db2.gz	SWNWOGBCPNSYHF-UHFFFAOYSA-N	-2	1	382.825	2.726	20	0		GFADML
CS(=O)(=O)[N-]c1ccccc1[N-]S(=O)(=O)c1cc(Cl)ccc1F	ZINC000551107794	564638124	/nfs/dbraw/zinc/63/81/24/564638124.db2.gz	DOPAOCQDPHTYFU-UHFFFAOYSA-N	-2	1	378.834	2.651	20	0		GFADML
C[C@@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F	ZINC000530459832	564882745	/nfs/dbraw/zinc/88/27/45/564882745.db2.gz	QKKUZRIRYNKXRH-LURJTMIESA-N	-2	1	388.642	2.773	20	0		GFADML
CO[C@@H](C[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-])C1CC1	ZINC000656168142	566108744	/nfs/dbraw/zinc/10/87/44/566108744.db2.gz	DEQSKZMTYAZVJH-SFYZADRCSA-N	-2	1	388.294	2.602	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-]C[C@]2(CC(=O)[O-])CC[C@H](C)C2)c(F)c1	ZINC000681581183	566115600	/nfs/dbraw/zinc/11/56/00/566115600.db2.gz	XSDJLKJGAVVQNO-MGPLVRAMSA-N	-2	1	377.409	2.533	20	0		GFADML
O=C([O-])C1(NC(=O)c2ccc(S(=O)(=O)[N-]c3ccccc3)cc2)CCCC1	ZINC000262530367	597037701	/nfs/dbraw/zinc/03/77/01/597037701.db2.gz	HZEWFLSQJPBORQ-UHFFFAOYSA-N	-2	1	388.445	2.615	20	0		GFADML
O=C([O-])CCCC[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br	ZINC000274916698	598165006	/nfs/dbraw/zinc/16/50/06/598165006.db2.gz	LUYJZHOEKHZISK-UHFFFAOYSA-N	-2	1	388.642	2.775	20	0		GFADML
Cc1ccc(C)c(S(=O)(=O)[N-]c2cccc(C(=O)NC[C@H](C)C(=O)[O-])c2)c1	ZINC000262473606	599777829	/nfs/dbraw/zinc/77/78/29/599777829.db2.gz	CIDGSJKQMYPNGL-AWEZNQCLSA-N	-2	1	390.461	2.555	20	0		GFADML
Cc1cc(=O)[nH]c(-c2ccc([N-]S(=O)(=O)c3cccc(C)c3C(=O)[O-])cc2)n1	ZINC000738313821	599842140	/nfs/dbraw/zinc/84/21/40/599842140.db2.gz	HFXSNPKZCSIQJI-UHFFFAOYSA-N	-2	1	399.428	2.553	20	0		GFADML
COc1ccc([C@@H](NC(=O)c2cc(Br)ccc2[O-])C(=O)[O-])cc1	ZINC000737963478	599850221	/nfs/dbraw/zinc/85/02/21/599850221.db2.gz	WZODXEKYCKUFAP-CQSZACIVSA-N	-2	1	380.194	2.719	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)c1	ZINC000477408084	599907014	/nfs/dbraw/zinc/90/70/14/599907014.db2.gz	UOHVHQLKLZCGFB-UHFFFAOYSA-N	-2	1	377.422	2.635	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccc(-c3nnc4n3CCCC4)cc2)c1	ZINC000365160511	599974368	/nfs/dbraw/zinc/97/43/68/599974368.db2.gz	QPLAISJLIKIZMX-UHFFFAOYSA-N	-2	1	398.444	2.780	20	0		GFADML
COC(=O)c1ccc(C(=O)[O-])c(S(=O)(=O)[N-]c2cccc([C@H](C)OC)c2)c1	ZINC000737681642	599981871	/nfs/dbraw/zinc/98/18/71/599981871.db2.gz	KBEAQQPCNODADK-NSHDSACASA-N	-2	1	393.417	2.680	20	0		GFADML
C[C@@H](CN(C)C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)c1ccccc1	ZINC000736576130	600121409	/nfs/dbraw/zinc/12/14/09/600121409.db2.gz	VQUZDPNZVJZASK-HNNXBMFYSA-N	-2	1	393.443	2.668	20	0		GFADML
Cc1cccc(S(=O)(=O)[N-]c2cccc(C[S@@](C)=O)c2C)c1C(=O)[O-]	ZINC000738746434	600254746	/nfs/dbraw/zinc/25/47/46/600254746.db2.gz	ZXRGFNSCPOSEHU-XMMPIXPASA-N	-2	1	381.475	2.681	20	0		GFADML
Cc1nc(-c2ccc(S(=O)(=O)[N-]c3cccc(OCC(=O)[O-])c3)cc2)co1	ZINC000738335024	600299324	/nfs/dbraw/zinc/29/93/24/600299324.db2.gz	LZBQLBBDLNOYMG-UHFFFAOYSA-N	-2	1	388.401	2.914	20	0		GFADML
CC(C)c1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cccc(C(=O)[O-])c1O	ZINC000436828460	600391616	/nfs/dbraw/zinc/39/16/16/600391616.db2.gz	YISNAEJQYZJASS-UHFFFAOYSA-N	-2	1	379.390	2.713	20	0		GFADML
CC(C)(CNC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)c1cccs1	ZINC000736322272	600424500	/nfs/dbraw/zinc/42/45/00/600424500.db2.gz	UPYKTRQMWPREBE-UHFFFAOYSA-N	-2	1	399.472	2.562	20	0		GFADML
CC(C)S(=O)(=O)Cc1cccc([N-]S(=O)(=O)c2ccccc2C(=O)[O-])c1	ZINC000736499597	600488462	/nfs/dbraw/zinc/48/84/62/600488462.db2.gz	JDLAPQOXFCVJQN-UHFFFAOYSA-N	-2	1	397.474	2.509	20	0		GFADML
Cc1ccc2c([O-])c(C(=O)NCc3ccc(OCCCC(=O)[O-])cc3)cnc2n1	ZINC000738666650	600536777	/nfs/dbraw/zinc/53/67/77/600536777.db2.gz	TZWZUDYBGQGSIG-UHFFFAOYSA-N	-2	1	395.415	2.817	20	0		GFADML
Cc1ccc2c(n1)[n-]cc(C(=O)NCc1ccc(OCCCC(=O)[O-])cc1)c2=O	ZINC000738666650	600536778	/nfs/dbraw/zinc/53/67/78/600536778.db2.gz	TZWZUDYBGQGSIG-UHFFFAOYSA-N	-2	1	395.415	2.817	20	0		GFADML
O=C([O-])c1ccnc([N-]S(=O)(=O)/C=C/c2cccc(Br)c2)c1	ZINC000740248921	600577023	/nfs/dbraw/zinc/57/70/23/600577023.db2.gz	LRZTXQZEESSBPS-FNORWQNLSA-N	-2	1	383.223	2.955	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3)cc1C(=O)[O-]	ZINC000831434841	600688238	/nfs/dbraw/zinc/68/82/38/600688238.db2.gz	GMJIRDZLGYCQLL-UHFFFAOYSA-N	-2	1	389.429	2.851	20	0		GFADML
COCCOc1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737822567	600890810	/nfs/dbraw/zinc/89/08/10/600890810.db2.gz	VWIOSXBIMJBRAT-UHFFFAOYSA-N	-2	1	385.825	2.864	20	0		GFADML
CCOC(=O)Cc1cccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000737142200	600894169	/nfs/dbraw/zinc/89/41/69/600894169.db2.gz	AXQFTTWZZWHOJL-UHFFFAOYSA-N	-2	1	397.836	2.945	20	0		GFADML
C[C@H]1CC(C)(C)CC[C@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000828161788	601139952	/nfs/dbraw/zinc/13/99/52/601139952.db2.gz	PKMWYAGFJRSNSU-SUMWQHHRSA-N	-2	1	385.464	2.737	20	0		GFADML
Cc1oc(S(=O)(=O)[N-]c2ccc3nc([C@@H]4CCCO4)[nH]c3c2)cc1C(=O)[O-]	ZINC000833030358	601233277	/nfs/dbraw/zinc/23/32/77/601233277.db2.gz	UDULEWCIWRTNQE-AWEZNQCLSA-N	-2	1	391.405	2.815	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])cc1C(=O)N(C)C	ZINC000832953035	601250884	/nfs/dbraw/zinc/25/08/84/601250884.db2.gz	ZGLCWYOXLWGMGW-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(NC(=O)C3CC3)c2)ccc1F	ZINC000028251240	601321085	/nfs/dbraw/zinc/32/10/85/601321085.db2.gz	GQAREHPTAUHMSZ-UHFFFAOYSA-N	-2	1	378.381	2.673	20	0		GFADML
COCCOCc1cccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000831767339	601325181	/nfs/dbraw/zinc/32/51/81/601325181.db2.gz	LDJPJHOKUROUFZ-JXMROGBWSA-N	-2	1	391.445	2.748	20	0		GFADML
COCCOc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1F	ZINC000516238125	601326071	/nfs/dbraw/zinc/32/60/71/601326071.db2.gz	FIWHLMMBNFPSBT-UHFFFAOYSA-N	-2	1	397.424	2.967	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1	ZINC000826127446	601333091	/nfs/dbraw/zinc/33/30/91/601333091.db2.gz	VEDSZUDLFGIQPQ-LFYBBSHMSA-N	-3	1	389.429	2.947	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3ccc(C)c(C(=O)[O-])c3)cc21	ZINC000266515012	601334560	/nfs/dbraw/zinc/33/45/60/601334560.db2.gz	CBDNDLRPDADYNB-UHFFFAOYSA-N	-2	1	388.445	2.793	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(N3CCCCC3)nc2)ccc1F	ZINC000833305875	601360357	/nfs/dbraw/zinc/36/03/57/601360357.db2.gz	MLTYJQMUGFMZLT-UHFFFAOYSA-N	-2	1	379.413	2.710	20	0		GFADML
CC[C@@H](NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C)c2)cc1)C(=O)[O-]	ZINC000486187703	601751004	/nfs/dbraw/zinc/75/10/04/601751004.db2.gz	KOLXBQLZGSFHNJ-MRXNPFEDSA-N	-2	1	394.424	2.528	20	0		GFADML
CC[C@H](NC(=O)c1cc(S(=O)(=O)[N-]c2cccc(C)c2)ccc1C)C(=O)[O-]	ZINC000263054966	601752657	/nfs/dbraw/zinc/75/26/57/601752657.db2.gz	XIGUOFDTBHQFTO-KRWDZBQOSA-N	-2	1	390.461	2.697	20	0		GFADML
CC[C@H](NC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2)c1)C(=O)[O-]	ZINC000485872016	601752834	/nfs/dbraw/zinc/75/28/34/601752834.db2.gz	CWUGBPSBSWLCIG-HNNXBMFYSA-N	-2	1	396.852	2.734	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(-n3cncn3)c(F)c2)ccc1Cl	ZINC000743729542	601829103	/nfs/dbraw/zinc/82/91/03/601829103.db2.gz	NFELQAIQNICVOY-UHFFFAOYSA-N	-2	1	396.787	2.559	20	0		GFADML
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)c1	ZINC000751141331	601830692	/nfs/dbraw/zinc/83/06/92/601830692.db2.gz	DLQHSXAOGSVYGI-UHFFFAOYSA-N	-2	1	385.344	2.559	20	0		GFADML
CCC(=O)Nc1ccc(Cl)c([N-]S(=O)(=O)c2csnc2C(=O)[O-])c1	ZINC000828570347	601835627	/nfs/dbraw/zinc/83/56/27/601835627.db2.gz	AKTDHSFORFLXHI-UHFFFAOYSA-N	-2	1	389.842	2.644	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(NC(=O)C2CC2)cc1	ZINC000833295575	601857619	/nfs/dbraw/zinc/85/76/19/601857619.db2.gz	ZPWXVWGYEFDYLQ-UHFFFAOYSA-N	-2	1	378.381	2.673	20	0		GFADML
Cc1c(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2Cl)cnn1-c1ccccn1	ZINC000548197284	602153679	/nfs/dbraw/zinc/15/36/79/602153679.db2.gz	JISAXLPBPHEWKA-UHFFFAOYSA-N	-2	1	392.824	2.728	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CN(C(=O)[O-])CC3)cc1OC	ZINC000739932872	602490968	/nfs/dbraw/zinc/49/09/68/602490968.db2.gz	NDRSMZXSPKIAIF-UHFFFAOYSA-N	-2	1	392.433	2.541	20	0		GFADML
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3ccc(NC(=O)[O-])cc3)cc2C[C@H]1C	ZINC000738536782	602646094	/nfs/dbraw/zinc/64/60/94/602646094.db2.gz	IAVQRUJFGIJUSH-LLVKDONJSA-N	-2	1	389.433	2.875	20	0		GFADML
O=C([O-])Nc1ccc(F)c([N-]S(=O)(=O)c2cnn(-c3ccccc3)c2)c1	ZINC000740702809	602653519	/nfs/dbraw/zinc/65/35/19/602653519.db2.gz	BTKDDKSTWUGDAU-UHFFFAOYSA-N	-2	1	376.369	2.902	20	0		GFADML
CCN(Cc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)C(=O)OC2)C(=O)[O-]	ZINC000739443873	602653728	/nfs/dbraw/zinc/65/37/28/602653728.db2.gz	FRKSBBBMHUBMJK-UHFFFAOYSA-N	-2	1	390.417	2.658	20	0		GFADML
CCN(Cc1cccc([N-]S(=O)(=O)c2cccc(C(=O)OC)c2)c1)C(=O)[O-]	ZINC000739446484	602654202	/nfs/dbraw/zinc/65/42/02/602654202.db2.gz	JOEUGROXMGVOMT-UHFFFAOYSA-N	-2	1	392.433	2.774	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cccc(CNC(=O)[O-])c2)c2cccnc12	ZINC000739933961	602655518	/nfs/dbraw/zinc/65/55/18/602655518.db2.gz	WKDMYYMHPPPLFF-UHFFFAOYSA-N	-2	1	387.417	2.812	20	0		GFADML
CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000739305122	602856785	/nfs/dbraw/zinc/85/67/85/602856785.db2.gz	LNHQNHGXXDUUCC-STQMWFEESA-N	-2	1	377.441	2.639	20	0		GFADML
CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000739593529	602859026	/nfs/dbraw/zinc/85/90/26/602859026.db2.gz	OJZSBPOAEFQRRL-CYBMUJFWSA-N	-2	1	393.440	2.954	20	0		GFADML
O=C([O-])N1CCC[C@H]1C[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F	ZINC000740520401	603086225	/nfs/dbraw/zinc/08/62/25/603086225.db2.gz	KQXOOROVNNUHDM-QMMMGPOBSA-N	-2	1	386.779	2.780	20	0		GFADML
O=C([O-])N1CCc2ccc([N-]S(=O)(=O)c3cc(F)c(F)c(F)c3)cc2C1	ZINC000740528793	603229726	/nfs/dbraw/zinc/22/97/26/603229726.db2.gz	BKCIUUPWFKLWDL-UHFFFAOYSA-N	-2	1	386.351	2.941	20	0		GFADML
CCOc1cc(-c2noc(C[C@@H](C)NC(=O)[O-])n2)cc(Br)c1[O-]	ZINC000827410104	603409022	/nfs/dbraw/zinc/40/90/22/603409022.db2.gz	WPHAYGWKDJTBIT-SSDOTTSWSA-N	-2	1	386.202	2.802	20	0		GFADML
CN(C(=O)[O-])[C@@H]1CCN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C1	ZINC000827872034	603608621	/nfs/dbraw/zinc/60/86/21/603608621.db2.gz	WHTKHAZPUIKVDO-GFCCVEGCSA-N	-2	1	379.413	2.564	20	0		GFADML
CCc1cc2c(COC(=O)[C@H]3CCC[C@H](NC(=O)[O-])C3)cc(=O)oc2cc1[O-]	ZINC000827568474	603872861	/nfs/dbraw/zinc/87/28/61/603872861.db2.gz	BXQOQUPNYROWSW-JSGCOSHPSA-N	-2	1	389.404	2.931	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(C(F)(F)F)c2)c1	ZINC000431191638	604398759	/nfs/dbraw/zinc/39/87/59/604398759.db2.gz	JXPXPVSSSGSREL-UHFFFAOYSA-N	-3	1	389.307	2.903	20	0		GFADML
CCC(=O)c1cccc(S(=O)(=O)[N-]c2cc(OC)c(OC)cc2C(=O)[O-])c1	ZINC000484587174	604788338	/nfs/dbraw/zinc/78/83/38/604788338.db2.gz	URLPPVBPJPOQHH-UHFFFAOYSA-N	-2	1	393.417	2.796	20	0		GFADML
Cc1ccc(-c2[nH]nc([N-]S(=O)(=O)c3cc(C(=O)[O-])ccc3F)c2C)o1	ZINC000135405603	604808053	/nfs/dbraw/zinc/80/80/53/604808053.db2.gz	IOWOFTHUYVNXQH-UHFFFAOYSA-N	-2	1	379.369	2.925	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCCc2nc(-c3ccccn3)cs2)c([O-])c1	ZINC000834258079	605649949	/nfs/dbraw/zinc/64/99/49/605649949.db2.gz	UAKUWVYCKYZINJ-UHFFFAOYSA-N	-2	1	384.417	2.973	20	0		GFADML
O=C([N-][N-]S(=O)(=O)c1ccc(Br)cc1Cl)C1CCCC1	ZINC000029044759	654574109	/nfs/dbraw/zinc/57/41/09/654574109.db2.gz	PIIQLFWNGLWUMI-UHFFFAOYSA-N	-2	1	381.679	2.602	20	0		GFADML
C[C@@H](CC(=O)[O-])[N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000037413135	654615051	/nfs/dbraw/zinc/61/50/51/654615051.db2.gz	XTQCLVWFKHHBLW-YFKPBYRVSA-N	-2	1	391.070	2.897	20	0		GFADML
CN(C)C(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2)ccc1Cl	ZINC000042008442	654634303	/nfs/dbraw/zinc/63/43/03/654634303.db2.gz	LXBDSSZELBOACW-UHFFFAOYSA-N	-2	1	382.825	2.541	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(C(N)=O)c(Cl)c1	ZINC000042796861	654645101	/nfs/dbraw/zinc/64/51/01/654645101.db2.gz	DXSLKTKWZGJXIM-UHFFFAOYSA-N	-2	1	382.825	2.500	20	0		GFADML
CSc1nc(C)c(CCC(=O)[N-]S(=O)(=O)c2ccccc2F)c(=O)[n-]1	ZINC000048592539	654709803	/nfs/dbraw/zinc/70/98/03/654709803.db2.gz	FFMFESGBIJSJOR-UHFFFAOYSA-N	-2	1	385.442	2.630	20	0		GFADML
O=C([O-])[C@@H]1C=C[C@H]([N-]S(=O)(=O)c2c(Cl)cc(F)cc2Br)C1	ZINC000275040057	655213276	/nfs/dbraw/zinc/21/32/76/655213276.db2.gz	QYSVJSFNEKBBHR-SVRRBLITSA-N	-2	1	398.637	2.549	20	0		GFADML
O=C([O-])[C@H](O)[C@@H](CC1CCCCC1)[N-]S(=O)(=O)c1cc(Cl)ccc1F	ZINC000578017291	655471235	/nfs/dbraw/zinc/47/12/35/655471235.db2.gz	XJTRSKKBIHPJTJ-UKRRQHHQSA-N	-2	1	393.864	2.542	20	0		GFADML
CC[C@@H](C[N-]S(=O)(=O)c1cc(C(=O)[O-])c(F)cc1F)CC(F)(F)F	ZINC000840899700	661204187	/nfs/dbraw/zinc/20/41/87/661204187.db2.gz	QODBACQOQUVMEJ-SSDOTTSWSA-N	-2	1	375.315	2.920	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc([S@](C)=O)c2)cc(C(=O)[O-])c1Cl	ZINC000759097870	655947615	/nfs/dbraw/zinc/94/76/15/655947615.db2.gz	QTWUOQHRMCLLFI-QHCPKHFHSA-N	-2	1	387.866	2.885	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccccc2[C@H](O)C(F)(F)F)c1	ZINC000777745502	656834122	/nfs/dbraw/zinc/83/41/22/656834122.db2.gz	YVKPBYMKXDWIPZ-ZDUSSCGKSA-N	-2	1	375.324	2.781	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2cccc3c2COC3=O)cc(C(=O)[O-])c1Cl	ZINC000808127394	659879205	/nfs/dbraw/zinc/87/92/05/659879205.db2.gz	YQGYIQHHLJEHOS-UHFFFAOYSA-N	-2	1	381.793	2.818	20	0		GFADML
CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1[N-]S(=O)(=O)c1c(Cl)ccnc1Cl	ZINC000849457394	661728802	/nfs/dbraw/zinc/72/88/02/661728802.db2.gz	FDCWXXSMAHUKCX-SCZZXKLOSA-N	-2	1	381.281	2.946	20	0		GFADML
Cc1csc([C@H](C)C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)n1	ZINC000871939360	662743915	/nfs/dbraw/zinc/74/39/15/662743915.db2.gz	AGKMYCUWQGASLF-SSDOTTSWSA-N	-2	1	376.406	2.510	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC[C@@H](CF)C1	ZINC000881666068	662999117	/nfs/dbraw/zinc/99/91/17/662999117.db2.gz	SZZAZEKJDXTINB-NSHDSACASA-N	-2	1	384.454	2.686	20	0		GFADML
O=C([O-])C1(CCCC[N-]S(=O)(=O)c2ccc(Br)o2)CCC1	ZINC000899955061	663704219	/nfs/dbraw/zinc/70/42/19/663704219.db2.gz	RAZNDNIBUYQKAV-UHFFFAOYSA-N	-2	1	380.260	2.746	20	0		GFADML
CCc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(N)=O)c2)cc1C(=O)[O-]	ZINC000327064276	563456633	/nfs/dbraw/zinc/45/66/33/563456633.db2.gz	SHGQURCAEBVIPR-UHFFFAOYSA-N	-2	1	382.825	2.500	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(OCCCO)cc2)c(Cl)c1	ZINC000507580939	564233211	/nfs/dbraw/zinc/23/32/11/564233211.db2.gz	IBHHZVLTFCRJFB-UHFFFAOYSA-N	-2	1	385.825	2.600	20	0		GFADML
CSc1cc2c(cc1[N-]S(=O)(=O)c1cccc(C(=O)[O-])c1)OCCO2	ZINC000509611896	564306289	/nfs/dbraw/zinc/30/62/89/564306289.db2.gz	VHBAPGXZIAVRMO-UHFFFAOYSA-N	-2	1	381.431	2.679	20	0		GFADML
FC(F)(F)c1nc(=NCCCCN=c2nc(C(F)(F)F)[n-]s2)s[n-]1	ZINC000566325930	564322996	/nfs/dbraw/zinc/32/29/96/564322996.db2.gz	HGQLGWYWQSFQHR-UHFFFAOYSA-N	-2	1	392.354	2.575	20	0		GFADML
FC(F)(F)c1nsc(=NCCCCN=c2nc(C(F)(F)F)[n-]s2)[n-]1	ZINC000566325930	564323002	/nfs/dbraw/zinc/32/30/02/564323002.db2.gz	HGQLGWYWQSFQHR-UHFFFAOYSA-N	-2	1	392.354	2.575	20	0		GFADML
CC1(C)CCC([N-]S(=O)(=O)c2ccc(Br)o2)(C(=O)[O-])CC1	ZINC000542859080	564329784	/nfs/dbraw/zinc/32/97/84/564329784.db2.gz	TWKAHSYNIQKXDI-UHFFFAOYSA-N	-2	1	380.260	2.744	20	0		GFADML
Cc1c(Cl)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(F)c(C(=O)[O-])c1	ZINC000476261990	564332236	/nfs/dbraw/zinc/33/22/36/564332236.db2.gz	VOSUGPRLHLQMFW-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1)c1nc(C(C)(C)C)no1	ZINC000567382499	564368962	/nfs/dbraw/zinc/36/89/62/564368962.db2.gz	IBSIXBSHGBGYJM-QMMMGPOBSA-N	-2	1	387.845	2.758	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)[N-]c2cccc3c2CCO3)cc1Br	ZINC000478691981	564412190	/nfs/dbraw/zinc/41/21/90/564412190.db2.gz	MXKVFRIPZHRJRG-UHFFFAOYSA-N	-2	1	398.234	2.883	20	0		GFADML
CCc1ccc([C@@H](COC)[N-]S(=O)(=O)c2ccc(C(=O)[O-])cc2Cl)o1	ZINC000546958821	564475348	/nfs/dbraw/zinc/47/53/48/564475348.db2.gz	YHVXUNNWXAMHMC-CYBMUJFWSA-N	-2	1	387.841	2.860	20	0		GFADML
CCC[C@H](C)CS(=O)(=O)[N-]c1c(C(=O)[O-])cc(OC)c(OC)c1OC	ZINC000547546868	564492672	/nfs/dbraw/zinc/49/26/72/564492672.db2.gz	BWXHJSPIBHCVQT-JTQLQIEISA-N	-2	1	375.443	2.589	20	0		GFADML
CC[C@@](C)(C[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000548223644	564539094	/nfs/dbraw/zinc/53/90/94/564539094.db2.gz	OJEPPLRTXPKLSM-JTQLQIEISA-N	-2	1	390.708	2.943	20	0		GFADML
C[C@H](CCC[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000548544711	564558179	/nfs/dbraw/zinc/55/81/79/564558179.db2.gz	IYVIYFZNNCVLPD-ZCFIWIBFSA-N	-2	1	390.708	2.943	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1C[C@@H]2C[C@H]1CS2	ZINC000571640819	564560165	/nfs/dbraw/zinc/56/01/65/564560165.db2.gz	LTZASWIYGAOAFC-RYUDHWBXSA-N	-2	1	396.515	2.584	20	0		GFADML
O=C([O-])C[C@H](C[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F)C(F)F	ZINC000572042229	564578940	/nfs/dbraw/zinc/57/89/40/564578940.db2.gz	LOGLKUWZRQGTLQ-ZCFIWIBFSA-N	-2	1	395.733	2.993	20	0		GFADML
O=C([O-])[C@@H](O)[C@H](CC1CCCCC1)[N-]S(=O)(=O)c1c(F)cccc1Cl	ZINC000549549334	564597579	/nfs/dbraw/zinc/59/75/79/564597579.db2.gz	RGGPVSKRXBMOFJ-KBPBESRZSA-N	-2	1	393.864	2.542	20	0		GFADML
Cc1ccc(Cl)c(C(=O)[O-])c1[N-]S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000484824002	564600000	/nfs/dbraw/zinc/60/00/00/564600000.db2.gz	VCYFQPHQXDUNOZ-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c(F)c1	ZINC000573603340	564646522	/nfs/dbraw/zinc/64/65/22/564646522.db2.gz	ZSBCIZKUPLYUAO-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
CC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(F)c2)ccc1Cl	ZINC000489693414	564748973	/nfs/dbraw/zinc/74/89/73/564748973.db2.gz	DLGHYQNTSIONPZ-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
O=C([O-])CC[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1ccc(Br)o1	ZINC000582650344	564856442	/nfs/dbraw/zinc/85/64/42/564856442.db2.gz	OKDLTIVAKUNBOJ-ZJUUUORDSA-N	-2	1	380.260	2.744	20	0		GFADML
COc1ccc(Cl)c(C(=O)[O-])c1NS(=O)(=O)c1cccc(C(=O)[O-])c1	ZINC000505126587	565049364	/nfs/dbraw/zinc/04/93/64/565049364.db2.gz	ZOZSSWBERLRZMU-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](C(=O)[O-])C2(C)CCCCC2)c(F)c1	ZINC000681952130	566133631	/nfs/dbraw/zinc/13/36/31/566133631.db2.gz	MHBKRSUITQHOAV-AWEZNQCLSA-N	-2	1	377.409	2.675	20	0		GFADML
COc1cc(-c2noc(C(=O)[N-]c3cc(C)on3)n2)cc(Br)c1[O-]	ZINC000683593621	566205425	/nfs/dbraw/zinc/20/54/25/566205425.db2.gz	OTMYZZTUOCPSIS-UHFFFAOYSA-N	-2	1	395.169	2.762	20	0		GFADML
O=C([O-])COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)cc1	ZINC000738617070	596984563	/nfs/dbraw/zinc/98/45/63/596984563.db2.gz	SQDUUFXQSFRPHK-UHFFFAOYSA-N	-2	1	387.772	2.521	20	0		GFADML
Cc1cc2c[nH]nc2cc1[N-]S(=O)(=O)c1ccc(OCCC(=O)[O-])cc1	ZINC000738479483	599851597	/nfs/dbraw/zinc/85/15/97/599851597.db2.gz	RHCMMAZGZZSRFC-UHFFFAOYSA-N	-2	1	375.406	2.526	20	0		GFADML
O=C([O-])CCc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)cc1	ZINC000738597666	599854066	/nfs/dbraw/zinc/85/40/66/599854066.db2.gz	BTCFDANFSXABMC-UHFFFAOYSA-N	-2	1	383.809	2.856	20	0		GFADML
CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NCC(=O)[O-])cc2)cc1	ZINC000013360044	599875022	/nfs/dbraw/zinc/87/50/22/599875022.db2.gz	AGRBXMJMGCEDPK-CYBMUJFWSA-N	-2	1	390.461	2.815	20	0		GFADML
O=C([O-])CCn1c(=O)c2ccccc2nc1SCC(=O)c1ccc([O-])cc1	ZINC000739781060	599883891	/nfs/dbraw/zinc/88/38/91/599883891.db2.gz	BTZPLLZFQFMOJI-UHFFFAOYSA-N	-2	1	384.413	2.552	20	0		GFADML
CCOC(=O)c1cc(S(=O)(=O)[N-]c2cc(OC)ccc2C(=O)[O-])ccc1F	ZINC000728507209	600006075	/nfs/dbraw/zinc/00/60/75/600006075.db2.gz	OVIGRWMMXOLMFM-UHFFFAOYSA-N	-2	1	397.380	2.510	20	0		GFADML
Cc1cccc(C[C@@H](C[N-]S(=O)(=O)c2ccc(F)c(F)c2F)C(=O)[O-])c1	ZINC000547898076	600096190	/nfs/dbraw/zinc/09/61/90/600096190.db2.gz	IPIUKLJNTLBHGS-LBPRGKRZSA-N	-2	1	387.379	2.634	20	0		GFADML
CN(C)c1ccc([N-]S(=O)(=O)c2cc(C(F)(F)F)ccc2C(=O)[O-])cn1	ZINC000737376341	600126701	/nfs/dbraw/zinc/12/67/01/600126701.db2.gz	UGQDSQRPVFJNCU-UHFFFAOYSA-N	-2	1	389.355	2.665	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CCC(=O)N(CC(=O)[O-])c1ccccc1	ZINC000548907714	600198062	/nfs/dbraw/zinc/19/80/62/600198062.db2.gz	PISULKLRRAOEFR-UHFFFAOYSA-N	-2	1	392.415	2.603	20	0		GFADML
Cc1ccc([C@H]2CCCN2C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)o1	ZINC000738584084	600214275	/nfs/dbraw/zinc/21/42/75/600214275.db2.gz	SNOMCSMVARKXFD-QGZVFWFLSA-N	-2	1	395.415	2.671	20	0		GFADML
Cc1cc(Cl)c([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2F)c(C(=O)[O-])c1	ZINC000738399257	600244067	/nfs/dbraw/zinc/24/40/67/600244067.db2.gz	HXGCAEDPVNMZGB-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
CCOCCCN(C[C@@H](C)C(=O)[O-])C(=O)c1cc(Br)ccc1[O-]	ZINC000737167878	600484157	/nfs/dbraw/zinc/48/41/57/600484157.db2.gz	IFGSATDWLIVCSI-LLVKDONJSA-N	-2	1	388.258	2.744	20	0		GFADML
CC(=O)N1CCCc2ccc(S(=O)(=O)[N-]c3ccc(C)cc3C(=O)[O-])cc21	ZINC000605496773	600634694	/nfs/dbraw/zinc/63/46/94/600634694.db2.gz	ACZGVGJZWBTGGT-UHFFFAOYSA-N	-2	1	388.445	2.793	20	0		GFADML
COC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2cc(Cl)cc(C(=O)[O-])c2)c1	ZINC000326985064	600637441	/nfs/dbraw/zinc/63/74/41/600637441.db2.gz	WIGMQYOEZBOMPV-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1ccc(S(=O)(=O)Nc2cc(F)c(C(=O)[O-])c(F)c2)c(Cl)c1	ZINC000768502631	600686674	/nfs/dbraw/zinc/68/66/74/600686674.db2.gz	DSPIRLADZXJNOU-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)cc1C(=O)[O-]	ZINC000831435069	600688499	/nfs/dbraw/zinc/68/84/99/600688499.db2.gz	NBIUOXSRICJHNA-UHFFFAOYSA-N	-2	1	387.772	2.765	20	0		GFADML
Cc1ccc(N2CCOC2=O)cc1[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1C	ZINC000743268094	600691139	/nfs/dbraw/zinc/69/11/39/600691139.db2.gz	CIMSXLNEUFHYKL-UHFFFAOYSA-N	-2	1	390.417	2.759	20	0		GFADML
O=C([O-])Nc1cccc([N-]S(=O)(=O)c2ccc(N3CCOC3=O)cc2)c1	ZINC000740041529	600694090	/nfs/dbraw/zinc/69/40/90/600694090.db2.gz	SGZCHYAHDWGSFO-UHFFFAOYSA-N	-2	1	377.378	2.534	20	0		GFADML
CC(C)[C@@H]([N-]S(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1)c1nc(C2CC2)no1	ZINC000566177655	600736720	/nfs/dbraw/zinc/73/67/20/600736720.db2.gz	RWYDHWFVAVMONF-CYBMUJFWSA-N	-2	1	399.856	2.974	20	0		GFADML
CC(C)CC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])n(C)c2)cc1	ZINC000298240397	600809040	/nfs/dbraw/zinc/80/90/40/600809040.db2.gz	LYUSCZKTQXTVJT-UHFFFAOYSA-N	-2	1	379.438	2.509	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NCC(C)C)cc2)cc1C(=O)[O-]	ZINC000055639654	600811432	/nfs/dbraw/zinc/81/14/32/600811432.db2.gz	RWNXKCFZCYEXLO-UHFFFAOYSA-N	-2	1	390.461	2.880	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)ccc1C(=O)NC(C)C	ZINC000285084009	600892766	/nfs/dbraw/zinc/89/27/66/600892766.db2.gz	KWQBIJRYRDRKQO-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
Cc1nccn1-c1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2)cn1	ZINC000833009023	600979130	/nfs/dbraw/zinc/97/91/30/600979130.db2.gz	IQSLRWTXJQSZAU-UHFFFAOYSA-N	-2	1	392.824	2.728	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)cc1O	ZINC000318068542	601117373	/nfs/dbraw/zinc/11/73/73/601117373.db2.gz	GHTBWTKCCVAUOU-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
Cc1nc(-c2cccnc2)[n-]c(=O)c1CCC(=O)NC1(CC(=O)[O-])CCCCC1	ZINC000663119577	601186898	/nfs/dbraw/zinc/18/68/98/601186898.db2.gz	MZRUIOQEZHKUEY-UHFFFAOYSA-N	-2	1	398.463	2.779	20	0		GFADML
COCCCOc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)c1	ZINC000432202078	601234679	/nfs/dbraw/zinc/23/46/79/601234679.db2.gz	MMXIGPJNPYASGG-UHFFFAOYSA-N	-2	1	379.434	2.909	20	0		GFADML
CCN(CC)C(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000013362657	601318915	/nfs/dbraw/zinc/31/89/15/601318915.db2.gz	ZPAROTMUELZFJB-UHFFFAOYSA-N	-2	1	394.424	2.807	20	0		GFADML
CCOC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000057122533	601325474	/nfs/dbraw/zinc/32/54/74/601325474.db2.gz	GTPGWWOHFXQJAC-UHFFFAOYSA-N	-2	1	396.396	2.917	20	0		GFADML
Cc1cc(C(=O)[O-])cc(S(=O)(=O)[N-]c2ccc(C(=O)NC(C)C)cc2)c1C	ZINC000614862034	601326271	/nfs/dbraw/zinc/32/62/71/601326271.db2.gz	ANHQNQOBBFOIHI-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
COC(=O)/C=C\c1ccc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)cc1	ZINC000831125179	601330501	/nfs/dbraw/zinc/33/05/01/601330501.db2.gz	YRUPOAVLATVITH-QPEQYQDCSA-N	-2	1	389.429	2.691	20	0		GFADML
Cn1ccnc1-c1cccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000833059632	601360411	/nfs/dbraw/zinc/36/04/11/601360411.db2.gz	XMRXGAVBABCQST-YFHOEESVSA-N	-2	1	383.429	2.986	20	0		GFADML
O=C([O-])Cc1ccc(S(=O)(=O)[N-]c2cc3ccccc3cc2C(=O)[O-])cc1	ZINC000739886430	601474874	/nfs/dbraw/zinc/47/48/74/601474874.db2.gz	OVOHHZXJLUAORU-UHFFFAOYSA-N	-3	1	385.397	2.966	20	0		GFADML
COc1ccc(CCC(=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)[O-])cc1C	ZINC000466287120	601488221	/nfs/dbraw/zinc/48/82/21/601488221.db2.gz	HJSIBGHEWGTHOU-UHFFFAOYSA-N	-2	1	393.417	2.520	20	0		GFADML
CSc1nc(C)c(CCC(=O)Nc2nc(CCCC(=O)[O-])cs2)c(=O)[n-]1	ZINC000832794610	601745003	/nfs/dbraw/zinc/74/50/03/601745003.db2.gz	JQCRXYCAJLIVNU-UHFFFAOYSA-N	-2	1	396.494	2.648	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2cccc(N3CCCC3=O)c2)ccc1Cl	ZINC000013032204	601826354	/nfs/dbraw/zinc/82/63/54/601826354.db2.gz	DAEORLGRVROGTF-UHFFFAOYSA-N	-2	1	394.836	2.966	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2C)ccc1Cl	ZINC000757473858	601827928	/nfs/dbraw/zinc/82/79/28/601827928.db2.gz	QNKAWFLQHILDHA-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1nscc1S(=O)(=O)[N-]c1ccc(Br)cc1F	ZINC000833345062	601830905	/nfs/dbraw/zinc/83/09/05/601830905.db2.gz	JTRYCKJVPNUYOS-UHFFFAOYSA-N	-2	1	381.204	2.544	20	0		GFADML
COC(=O)CCc1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1	ZINC000751141421	601840770	/nfs/dbraw/zinc/84/07/70/601840770.db2.gz	BEFREQJPRRLFAT-UHFFFAOYSA-N	-2	1	399.371	2.569	20	0		GFADML
O=C([O-])c1ccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)cc1F	ZINC000754757583	602322456	/nfs/dbraw/zinc/32/24/56/602322456.db2.gz	BAKWPVCOZNESDV-UHFFFAOYSA-N	-2	1	391.735	2.815	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCC(NC(=O)[O-])CC2)c([O-])c1	ZINC000738724737	602850980	/nfs/dbraw/zinc/85/09/80/602850980.db2.gz	YDRUMJJHYCWTQR-UHFFFAOYSA-N	-2	1	379.413	2.611	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])C[C@H](C)N1C(=O)[O-]	ZINC000739172734	602864760	/nfs/dbraw/zinc/86/47/60/602864760.db2.gz	XGRGHNFKEARFNQ-RYUDHWBXSA-N	-2	1	393.440	2.952	20	0		GFADML
CC(C)[C@H](C[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)NC(=O)[O-]	ZINC000738792466	603084950	/nfs/dbraw/zinc/08/49/50/603084950.db2.gz	HDLIGVZXLHVXFL-JTQLQIEISA-N	-2	1	388.795	2.929	20	0		GFADML
C[C@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1	ZINC000825449586	603400288	/nfs/dbraw/zinc/40/02/88/603400288.db2.gz	UJEKEXQDTJRUIM-VIFPVBQESA-N	-3	1	382.369	2.653	20	0		GFADML
Cc1ccc2c([O-])c(C(=O)N3CCC(N(CC4CC4)C(=O)[O-])CC3)cnc2n1	ZINC000830438734	603475571	/nfs/dbraw/zinc/47/55/71/603475571.db2.gz	LEPOLNQTJSVQAV-UHFFFAOYSA-N	-2	1	384.436	2.638	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)c([O-])c1	ZINC000832829181	604068880	/nfs/dbraw/zinc/06/88/80/604068880.db2.gz	OXCCJXSPFGRHNN-HNNXBMFYSA-N	-2	1	378.425	2.672	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)[O-])cc2F)o1	ZINC000833431186	604696436	/nfs/dbraw/zinc/69/64/36/604696436.db2.gz	OTNVDHWDKDRUEQ-UHFFFAOYSA-N	-2	1	399.396	2.551	20	0		GFADML
Cc1ccc(-c2n[nH]c([N-]S(=O)(=O)c3ccc(CC(=O)[O-])cc3)c2C)o1	ZINC000135404085	604808323	/nfs/dbraw/zinc/80/83/23/604808323.db2.gz	KJTVNGASAKMDRC-UHFFFAOYSA-N	-2	1	375.406	2.714	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2OC)c(C)c1	ZINC000833733457	604861088	/nfs/dbraw/zinc/86/10/88/604861088.db2.gz	QBTYRRPRGXZYRV-UHFFFAOYSA-N	-2	1	381.406	2.520	20	0		GFADML
Cc1ccc(Br)c([N-]S(=O)(=O)c2csnc2C(=O)[O-])c1	ZINC000833747568	604944300	/nfs/dbraw/zinc/94/43/00/604944300.db2.gz	WXIZSORCBZLHGY-UHFFFAOYSA-N	-2	1	377.241	2.713	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccccc2Oc2ncccc2-c2nn[n-]n2)o1	ZINC000826292814	608293246	/nfs/dbraw/zinc/29/32/46/608293246.db2.gz	NEJMJJWWJQMYFQ-UHFFFAOYSA-N	-2	1	398.404	2.756	20	0		GFADML
Cc1cc(O)c(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000031666060	654597578	/nfs/dbraw/zinc/59/75/78/654597578.db2.gz	SXZZQLFBRSQHOH-UHFFFAOYSA-N	-2	1	386.769	2.761	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2ccc(SC)cc2)cc(C(=O)[O-])c1OC	ZINC000045946330	654672705	/nfs/dbraw/zinc/67/27/05/654672705.db2.gz	CQGKVHNYQLOUPN-UHFFFAOYSA-N	-2	1	383.447	2.925	20	0		GFADML
CS(=O)(=O)[N-]c1ccccc1[N-]S(=O)(=O)c1cc(F)ccc1Cl	ZINC000103058501	655066114	/nfs/dbraw/zinc/06/61/14/655066114.db2.gz	FVXSBCAQZPSMGU-UHFFFAOYSA-N	-2	1	378.834	2.651	20	0		GFADML
Cc1nc(C[N-]S(=O)(=O)c2cc(Cl)sc2Cl)sc1C(=O)[O-]	ZINC000110788971	655159892	/nfs/dbraw/zinc/15/98/92/655159892.db2.gz	IBYAKXSOEDWUQI-UHFFFAOYSA-N	-2	1	387.291	2.997	20	0		GFADML
C[C@@H](C[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)CC(=O)[O-]	ZINC000274948153	655208469	/nfs/dbraw/zinc/20/84/69/655208469.db2.gz	FZVGMZQSZPNNEG-ZCFIWIBFSA-N	-2	1	388.642	2.631	20	0		GFADML
Cc1cc(S(=O)(=O)[N-]c2ccc(CC(=O)[O-])cc2)cc(C(=O)[O-])c1Cl	ZINC000762433595	656041755	/nfs/dbraw/zinc/04/17/55/656041755.db2.gz	VDEHRDZWPAQECB-UHFFFAOYSA-N	-3	1	383.809	2.775	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1ccc(Br)o1)CC1CCCC1	ZINC000776553088	656756603	/nfs/dbraw/zinc/75/66/03/656756603.db2.gz	QQWXXRKWFRJKTL-JTQLQIEISA-N	-2	1	380.260	2.602	20	0		GFADML
CC(C)=CCSC[C@@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)C(=O)[O-]	ZINC000776565212	656759132	/nfs/dbraw/zinc/75/91/32/656759132.db2.gz	YJCMYPAPMVEQNT-SNVBAGLBSA-N	-2	1	399.321	2.819	20	0		GFADML
Cc1cnc([C@H](C)C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)s1	ZINC000871940723	662744235	/nfs/dbraw/zinc/74/42/35/662744235.db2.gz	COMFPFBHHGFUKN-SSDOTTSWSA-N	-2	1	376.406	2.510	20	0		GFADML
C[C@H](CC(F)(F)F)[N-]S(=O)(=O)c1sc(C(=O)[O-])cc1Br	ZINC000871942702	662744669	/nfs/dbraw/zinc/74/46/69/662744669.db2.gz	XYKHPMRZXVYAMR-SCSAIBSYSA-N	-2	1	396.206	2.828	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccccc2Cl)cc1[N-]S(C)(=O)=O	ZINC000044259442	551143495	/nfs/dbraw/zinc/14/34/95/551143495.db2.gz	PAKCYWABQNXYGK-UHFFFAOYSA-N	-2	1	390.870	2.521	20	0		GFADML
CN(C)c1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(OCC(=O)[O-])cc1	ZINC000045769607	551147911	/nfs/dbraw/zinc/14/79/11/551147911.db2.gz	XJTOSAWYDUSNLE-UHFFFAOYSA-N	-2	1	384.841	2.670	20	0		GFADML
CNC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)ccc1Cl	ZINC000393079206	563528503	/nfs/dbraw/zinc/52/85/03/563528503.db2.gz	LGYGYRKPARAJCO-UHFFFAOYSA-N	-2	1	382.825	2.507	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(F)c2)ccc1Cl	ZINC000432645383	563590370	/nfs/dbraw/zinc/59/03/70/563590370.db2.gz	WONADOYFQOXOSH-UHFFFAOYSA-N	-2	1	389.788	2.752	20	0		GFADML
CSc1ccc(S(=O)(=O)[N-]c2ccc(-n3nn[n-]c3=O)cc2)cc1Cl	ZINC000443403762	563803990	/nfs/dbraw/zinc/80/39/90/563803990.db2.gz	CLIOYXALKFXCBX-UHFFFAOYSA-N	-2	1	397.869	2.544	20	0		GFADML
O=C([O-])c1cc(S(=O)(=O)[N-]c2ccc(OCC(F)(F)F)c(F)c2)c[nH]1	ZINC000443419974	563804780	/nfs/dbraw/zinc/80/47/80/563804780.db2.gz	XEZMNDUEVJETMO-UHFFFAOYSA-N	-2	1	382.291	2.594	20	0		GFADML
O=C([O-])c1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc2[nH]c(=O)ccc2c1	ZINC000542728243	564322955	/nfs/dbraw/zinc/32/29/55/564322955.db2.gz	HXBHXGICBZQBBK-UHFFFAOYSA-N	-2	1	378.793	2.681	20	0		GFADML
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])cc1	ZINC000542728922	564323251	/nfs/dbraw/zinc/32/32/51/564323251.db2.gz	MMXLOZADOIUYPM-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1ccc(Br)c(Cl)c1Cl)C(=O)[O-]	ZINC000479207253	564430957	/nfs/dbraw/zinc/43/09/57/564430957.db2.gz	JBWPQRKHYBMLOQ-SCSAIBSYSA-N	-2	1	377.043	2.507	20	0		GFADML
Cc1cc(Br)ccc1NS(=O)(=O)c1cc(C(=O)[O-])ccc1[O-]	ZINC000481432179	564512846	/nfs/dbraw/zinc/51/28/46/564512846.db2.gz	HDGFPXATQRNOSV-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
CC[C@H](C[N-]S(=O)(=O)c1cc(Br)sc1Cl)CC(=O)[O-]	ZINC000547933756	564522438	/nfs/dbraw/zinc/52/24/38/564522438.db2.gz	NUVYOTRFYSEART-LURJTMIESA-N	-2	1	390.708	2.943	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2ccc3[nH]c(=O)ccc3c2)ccc1Cl	ZINC000484556814	564591312	/nfs/dbraw/zinc/59/13/12/564591312.db2.gz	NRMNRTZELSZRBF-UHFFFAOYSA-N	-2	1	378.793	2.681	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br)[C@H](C)C(=O)[O-]	ZINC000574534700	564678514	/nfs/dbraw/zinc/67/85/14/564678514.db2.gz	WUHORZPHUHNPMD-NTSWFWBYSA-N	-2	1	388.642	2.629	20	0		GFADML
CCC(=O)C[C@H]([N-]S(=O)(=O)c1sc2ccccc2c1Cl)C(=O)[O-]	ZINC000556702279	564835837	/nfs/dbraw/zinc/83/58/37/564835837.db2.gz	OWFBHQDMJBYCJU-JTQLQIEISA-N	-2	1	375.855	2.655	20	0		GFADML
COC(=O)c1c(C)c([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)ccc1F	ZINC000583725460	564904015	/nfs/dbraw/zinc/90/40/15/564904015.db2.gz	MYNSAVXXJKRHDZ-UHFFFAOYSA-N	-2	1	387.410	2.790	20	0		GFADML
Cc1nc(S(=O)(=O)[N-]C[C@H](CC(=O)[O-])C(F)F)c(-c2ccccc2)s1	ZINC000663291018	565407185	/nfs/dbraw/zinc/40/71/85/565407185.db2.gz	LMJPLMBGXNWBNB-NSHDSACASA-N	-2	1	390.433	2.753	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2c[nH]c(C(=O)[O-])c2)ccc1OCC(F)(F)F	ZINC000606343663	565962301	/nfs/dbraw/zinc/96/23/01/565962301.db2.gz	UEESXQALFFPPLR-UHFFFAOYSA-N	-2	1	378.328	2.763	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1Cl	ZINC000609819271	566053271	/nfs/dbraw/zinc/05/32/71/566053271.db2.gz	FMMKLCMSFPQGTN-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])CCCCCNC(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1[O-]	ZINC000569810753	599738119	/nfs/dbraw/zinc/73/81/19/599738119.db2.gz	QABCXTMCVLTLHH-GOSISDBHSA-N	-2	1	398.459	2.911	20	0		GFADML
CC(C)(NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)c1ccc(F)cc1	ZINC000736339263	599952468	/nfs/dbraw/zinc/95/24/68/599952468.db2.gz	OZSGXMKWLRCAOF-UHFFFAOYSA-N	-2	1	397.406	2.597	20	0		GFADML
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)[N-]c2ccc(NC(=O)[O-])cc2)c1	ZINC000738252020	600057903	/nfs/dbraw/zinc/05/79/03/600057903.db2.gz	QZEYOUVGKCYIPD-UHFFFAOYSA-N	-2	1	398.462	2.598	20	0		GFADML
O=C([O-])Cc1cc(=O)n(-c2ccc(C(=O)Nc3nc4ccccc4s3)cc2)[n-]1	ZINC000739877543	600070134	/nfs/dbraw/zinc/07/01/34/600070134.db2.gz	QXGAMXPFFWEDHG-UHFFFAOYSA-N	-2	1	394.412	2.655	20	0		GFADML
O=C([O-])c1sccc1S(=O)(=O)[N-]c1ccc(O[C@H]2CCCC[C@@H]2O)cc1	ZINC000740291318	600245368	/nfs/dbraw/zinc/24/53/68/600245368.db2.gz	ZSZYZAPWDFKZQV-KBPBESRZSA-N	-2	1	397.474	2.929	20	0		GFADML
CC(C)(CC(=O)[O-])NC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)cc1	ZINC000736311136	600790015	/nfs/dbraw/zinc/79/00/15/600790015.db2.gz	IJWARXIWVYNNCP-UHFFFAOYSA-N	-2	1	394.424	2.610	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1csc(C(=O)[O-])c1)c1nc(-c2cccc(F)c2)no1	ZINC000827767579	600800635	/nfs/dbraw/zinc/80/06/35/600800635.db2.gz	DOKSYUPUUJRVKF-MRVPVSSYSA-N	-2	1	397.409	2.675	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3nnc4n3CCC4)cc2)cc1C(=O)[O-]	ZINC000832955785	600810006	/nfs/dbraw/zinc/81/00/06/600810006.db2.gz	FMPPAKZQBXQEQW-UHFFFAOYSA-N	-2	1	398.444	2.699	20	0		GFADML
CCOc1ccc(F)c(C(=O)[O-])c1NS(=O)(=O)c1ccc(C)c(C(=O)[O-])c1	ZINC000462100890	600817031	/nfs/dbraw/zinc/81/70/31/600817031.db2.gz	JOWXSTNDZASOKQ-UHFFFAOYSA-N	-2	1	397.380	2.730	20	0		GFADML
CC(=O)N1CCc2cc([N-]S(=O)(=O)c3cc(Cl)cc(C(=O)[O-])c3)ccc21	ZINC000736140061	600886883	/nfs/dbraw/zinc/88/68/83/600886883.db2.gz	VZDRYNJWKNAXSA-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
O=C([O-])c1cc(Cl)cc(S(=O)(=O)[N-]c2ccc3c(c2)NC(=O)CC3)c1	ZINC000740306016	600898913	/nfs/dbraw/zinc/89/89/13/600898913.db2.gz	QKNVBZWYVXUXNU-UHFFFAOYSA-N	-2	1	380.809	2.724	20	0		GFADML
CCC(CC)(NC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1)C(=O)[O-]	ZINC000566878314	600927918	/nfs/dbraw/zinc/92/79/18/600927918.db2.gz	GMKRSILINSZSON-UHFFFAOYSA-N	-2	1	390.461	2.861	20	0		GFADML
CCCS(=O)(=O)[N-]c1ccccc1C(=O)O[C@@H](C(=O)[O-])c1ccccc1F	ZINC000829545784	601114776	/nfs/dbraw/zinc/11/47/76/601114776.db2.gz	MDMNUQRGQDWYJK-MRXNPFEDSA-N	-2	1	395.408	2.960	20	0		GFADML
Cc1nc(-c2ccc(C)c([N-]S(=O)(=O)c3ccc(C(=O)[O-])c(C)c3)c2)n[nH]1	ZINC000507969389	601205352	/nfs/dbraw/zinc/20/53/52/601205352.db2.gz	VSAVCVPRNAQFQZ-UHFFFAOYSA-N	-2	1	386.433	2.896	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@@H](c2ccccc2)[C@H](C)C(=O)[O-])c(F)c1	ZINC000681579800	601225261	/nfs/dbraw/zinc/22/52/61/601225261.db2.gz	VRUPFIOXWGERHZ-ZUZCIYMTSA-N	-2	1	385.388	2.714	20	0		GFADML
CCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1	ZINC000829881402	601318457	/nfs/dbraw/zinc/31/84/57/601318457.db2.gz	IRHVEMRYUDYYKX-XGICHPGQSA-N	-2	1	375.402	2.762	20	0		GFADML
CCn1cnnc1-c1cccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000830435539	601322397	/nfs/dbraw/zinc/32/23/97/601322397.db2.gz	OXIDUROMYAVXDZ-FLIBITNWSA-N	-2	1	398.444	2.864	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)ccc1NC(C)=O	ZINC000832025866	601324859	/nfs/dbraw/zinc/32/48/59/601324859.db2.gz	FUHYWFCZSMFURW-YHYXMXQVSA-N	-2	1	390.417	2.552	20	0		GFADML
NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1Cl	ZINC000031721037	601827418	/nfs/dbraw/zinc/82/74/18/601827418.db2.gz	GOZHYPIMCWDJTK-UHFFFAOYSA-N	-2	1	389.216	2.591	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)ccc1C(=O)N(C)C	ZINC000740813214	601830069	/nfs/dbraw/zinc/83/00/69/601830069.db2.gz	YCLQKRLMJZDVPI-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1Cl	ZINC000833320770	601838411	/nfs/dbraw/zinc/83/84/11/601838411.db2.gz	IEZJXBLHKOQMQU-UHFFFAOYSA-N	-3	1	391.735	2.815	20	0		GFADML
COC(=O)Nc1cc([N-]S(=O)(=O)c2cccc(F)c2C(=O)[O-])ccc1F	ZINC000831206700	601861016	/nfs/dbraw/zinc/86/10/16/601861016.db2.gz	MFMRFAAKXYXFRV-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
C[C@@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1F)c1noc(-c2ccccc2)n1	ZINC000827747310	602172302	/nfs/dbraw/zinc/17/23/02/602172302.db2.gz	LQIJAQNMTVBAET-SNVBAGLBSA-N	-2	1	391.380	2.613	20	0		GFADML
CCc1ccc(-c2noc([C@@H](C)[N-]S(=O)(=O)c3ccc(C(=O)[O-])o3)n2)cc1	ZINC000830228942	602173134	/nfs/dbraw/zinc/17/31/34/602173134.db2.gz	IVODMNZOLCEOCP-SNVBAGLBSA-N	-2	1	391.405	2.630	20	0		GFADML
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc2c(c1)CCN2C(=O)[O-]	ZINC000739545096	602243737	/nfs/dbraw/zinc/24/37/37/602243737.db2.gz	QHYIHDLOAHNXTD-UHFFFAOYSA-N	-3	1	390.417	2.789	20	0		GFADML
O=C([O-])N[C@@H](Cc1ccccc1)C(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1	ZINC000740688640	602405405	/nfs/dbraw/zinc/40/54/05/602405405.db2.gz	FRLXLCADDLJFED-IBGZPJMESA-N	-2	1	396.443	2.692	20	0		GFADML
C[C@@H]1CN(c2ccc(NC(=O)c3ccc(NC(=O)[O-])cc3[O-])cn2)C[C@H](C)O1	ZINC000739192250	602850857	/nfs/dbraw/zinc/85/08/57/602850857.db2.gz	IPSSQENDVGZSET-TXEJJXNPSA-N	-2	1	386.408	2.743	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCC[C@@H](CNC(=O)[O-])C2)c([O-])c1	ZINC000738722252	602854115	/nfs/dbraw/zinc/85/41/15/602854115.db2.gz	CECSLRSXXVGXER-LBPRGKRZSA-N	-2	1	393.440	2.859	20	0		GFADML
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)c2ccc(NC(=O)[O-])cc2[O-])C1	ZINC000738707674	602862527	/nfs/dbraw/zinc/86/25/27/602862527.db2.gz	KOHVZTWXWLRNQI-LBPRGKRZSA-N	-2	1	393.440	2.859	20	0		GFADML
O=C([O-])NC1CCC(NC(=O)N2CCC(C(=O)c3ccc([O-])cc3)CC2)CC1	ZINC000740554099	603102061	/nfs/dbraw/zinc/10/20/61/603102061.db2.gz	FUEMWPMWVITSRA-UHFFFAOYSA-N	-2	1	389.452	2.575	20	0		GFADML
COc1ccc(NC(=O)c2ccc(NC(=O)[O-])cc2[O-])cc1N1CCOC1=O	ZINC000829474806	604028750	/nfs/dbraw/zinc/02/87/50/604028750.db2.gz	QPSIMJUZEMOXJP-UHFFFAOYSA-N	-2	1	387.348	2.700	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)ccc1C(=O)[O-]	ZINC000767735041	604632021	/nfs/dbraw/zinc/63/20/21/604632021.db2.gz	CDSQXISUHLAAMP-UHFFFAOYSA-N	-3	1	387.772	2.985	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)c1	ZINC000832096090	604634043	/nfs/dbraw/zinc/63/40/43/604634043.db2.gz	WYDRSSPCDDJDQP-UHFFFAOYSA-N	-2	1	380.422	2.614	20	0		GFADML
O=C([O-])[C@H]1CCCN1C(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-]	ZINC000821458366	604700553	/nfs/dbraw/zinc/70/05/53/604700553.db2.gz	YUYQOXNRNJRZLQ-OAHLLOKOSA-N	-2	1	390.342	2.612	20	0		GFADML
COc1cc(C(=O)[O-])sc1S(=O)(=O)[N-]c1n[nH]c(-c2ccc(C)o2)c1C	ZINC000831939365	604808271	/nfs/dbraw/zinc/80/82/71/604808271.db2.gz	KAOZIACYIVSYIL-UHFFFAOYSA-N	-2	1	397.434	2.856	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c(OC)c1C(=O)[O-]	ZINC000833734697	604859531	/nfs/dbraw/zinc/85/95/31/604859531.db2.gz	TZNNPUFDXVTWHW-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
Cc1cnn(-c2ccc(C(=O)[O-])cc2[N-]S(=O)(=O)c2ccc(F)cc2)c1	ZINC000833753935	605190753	/nfs/dbraw/zinc/19/07/53/605190753.db2.gz	DDYWAUMNNKLYTJ-UHFFFAOYSA-N	-2	1	375.381	2.819	20	0		GFADML
O=C([O-])N1CCCN1C(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1[O-]	ZINC000834051197	605316707	/nfs/dbraw/zinc/31/67/07/605316707.db2.gz	DFEHBTHINXXHGY-UHFFFAOYSA-N	-2	1	391.330	2.664	20	0		GFADML
CCc1cc(NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)ccc1C	ZINC000833671825	605415021	/nfs/dbraw/zinc/41/50/21/605415021.db2.gz	QILHQWXRBZJJHY-UHFFFAOYSA-N	-2	1	379.416	2.916	20	0		GFADML
O=C([O-])N[C@@H](C[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C1CC1	ZINC000834151316	605806213	/nfs/dbraw/zinc/80/62/13/605806213.db2.gz	SSVTXTUVWXZGPF-JTQLQIEISA-N	-2	1	386.779	2.683	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])[C@H](C)CN1C(=O)OC(C)(C)C	ZINC000833836326	605837405	/nfs/dbraw/zinc/83/74/05/605837405.db2.gz	NDAAHHRLXIWCNP-VXGBXAGGSA-N	-2	1	393.440	2.952	20	0		GFADML
O=C([O-])NCCCCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000834234825	605899907	/nfs/dbraw/zinc/89/99/07/605899907.db2.gz	LEHNYKXXUIRCOQ-UHFFFAOYSA-N	-2	1	391.449	2.864	20	0		GFADML
CCCc1ccc(S(=O)(=O)[N-]c2nn(C(C)(C)C)cc2-c2nn[n-]n2)cc1	ZINC000821143392	606621564	/nfs/dbraw/zinc/62/15/64/606621564.db2.gz	UPFBKVNCFHSZNP-UHFFFAOYSA-N	-2	1	389.485	2.572	20	0		GFADML
COC(=O)c1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C)c1Cl	ZINC000831471858	660711040	/nfs/dbraw/zinc/71/10/40/660711040.db2.gz	XQNBUIBGMCMUKN-UHFFFAOYSA-N	-2	1	389.838	2.996	20	0		GFADML
COc1c(Cl)cccc1NS(=O)(=O)c1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000057123415	654801233	/nfs/dbraw/zinc/80/12/33/654801233.db2.gz	GWUGYROVARGRJA-UHFFFAOYSA-N	-2	1	385.781	2.546	20	0		GFADML
O=C([N-]NC(=O)c1cccc(Br)c1)c1cc(F)c(F)c([O-])c1F	ZINC000182878257	655348006	/nfs/dbraw/zinc/34/80/06/655348006.db2.gz	PGHGPOQQFINOMA-UHFFFAOYSA-N	-2	1	389.127	2.647	20	0		GFADML
CS(=O)(=O)[N-]c1ccccc1[N-]S(=O)(=O)c1c(Cl)ccc(F)c1F	ZINC000577082976	655457424	/nfs/dbraw/zinc/45/74/24/655457424.db2.gz	WSEISCHCKQKNMO-UHFFFAOYSA-N	-2	1	396.824	2.791	20	0		GFADML
CC(C)(C)[S@@](=O)Cc1cccc([N-]S(=O)(=O)c2c[nH]c(C(=O)[O-])c2)c1	ZINC000265285595	655480423	/nfs/dbraw/zinc/48/04/23/655480423.db2.gz	QBTDWHHIGHCTSY-DEOSSOPVSA-N	-2	1	384.479	2.561	20	0		GFADML
C[C@H]1CSCCN1C(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000265659119	655488503	/nfs/dbraw/zinc/48/85/03/655488503.db2.gz	AOHUDJIAHPJARV-NSHDSACASA-N	-2	1	398.531	2.832	20	0		GFADML
CC(=O)OCCc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)c1	ZINC000763381115	656081506	/nfs/dbraw/zinc/08/15/06/656081506.db2.gz	GGCSDDGKQYLOEJ-UHFFFAOYSA-N	-2	1	383.447	2.661	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)cc1	ZINC000767735053	656217529	/nfs/dbraw/zinc/21/75/29/656217529.db2.gz	IRGVBSUFFQPHLU-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
O=C([O-])c1cc([N-]S(=O)(=O)c2ccc3nc(Cl)cnc3c2)ccc1F	ZINC000776445301	656742239	/nfs/dbraw/zinc/74/22/39/656742239.db2.gz	KTYQFIPLZRTNRN-UHFFFAOYSA-N	-2	1	381.772	2.921	20	0		GFADML
CC[C@H](C[N-]S(=O)(=O)c1cc(Br)sc1Cl)C(=O)[O-]	ZINC000776535681	656753501	/nfs/dbraw/zinc/75/35/01/656753501.db2.gz	CYWGAFHGLRMHLG-RXMQYKEDSA-N	-2	1	376.681	2.553	20	0		GFADML
O=C([O-])[C@@H](C[N-]S(=O)(=O)c1c(Cl)ccnc1Cl)CC1CCCC1	ZINC000776553576	656756759	/nfs/dbraw/zinc/75/67/59/656756759.db2.gz	XLVDQSMEKJABLM-SNVBAGLBSA-N	-2	1	381.281	2.948	20	0		GFADML
O=C([O-])C[C@@H](Cc1ccccc1)[N-]S(=O)(=O)c1c(Cl)ccnc1Cl	ZINC000776609473	656765755	/nfs/dbraw/zinc/76/57/55/656765755.db2.gz	CNDZHIGMWUMXQV-LLVKDONJSA-N	-2	1	389.260	2.753	20	0		GFADML
CNC(=O)Oc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000793453446	658398585	/nfs/dbraw/zinc/39/85/85/658398585.db2.gz	PRSUCEHMKOOBKQ-UHFFFAOYSA-N	-2	1	384.797	2.557	20	0		GFADML
COCC1(C[N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CCCCC1	ZINC000811682460	660014205	/nfs/dbraw/zinc/01/42/05/660014205.db2.gz	WODGLVHCKICAJC-UHFFFAOYSA-N	-2	1	377.409	2.538	20	0		GFADML
O=C([O-])C1CC2(C1)C[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1F)CCS2	ZINC000899949091	663703686	/nfs/dbraw/zinc/70/36/86/663703686.db2.gz	LLIMWSOCGXECIN-QMJNDHNRSA-N	-2	1	393.889	2.886	20	0		GFADML
CCn1nc(C)c([N-]S(=O)(=O)c2c([O-])cccc2OC(F)(F)F)c1C	ZINC000901895836	663749882	/nfs/dbraw/zinc/74/98/82/663749882.db2.gz	WAPAZBXSQXCSKJ-UHFFFAOYSA-N	-2	1	379.360	2.925	20	0		GFADML
COC(=O)Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000392601535	563527131	/nfs/dbraw/zinc/52/71/31/563527131.db2.gz	JPMNRUYMWVRCMU-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
CNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)c1	ZINC000438796396	563711233	/nfs/dbraw/zinc/71/12/33/563711233.db2.gz	MMCNWUQDNIFEFH-UHFFFAOYSA-N	-2	1	383.813	2.590	20	0		GFADML
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(OCC(F)(F)F)nc2)cc1	ZINC000476411626	564338138	/nfs/dbraw/zinc/33/81/38/564338138.db2.gz	ZHYYMYFZPRLVRN-UHFFFAOYSA-N	-2	1	376.312	2.522	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])ccc1F	ZINC000543659923	564358134	/nfs/dbraw/zinc/35/81/34/564358134.db2.gz	ZZBSYXQBDHKFRV-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
Cc1c(Cl)cc(S(=O)(=O)[N-]c2cccc(NC(N)=O)c2)cc1C(=O)[O-]	ZINC000479257581	564433456	/nfs/dbraw/zinc/43/34/56/564433456.db2.gz	IADMUEKFUGEICH-UHFFFAOYSA-N	-2	1	383.813	2.638	20	0		GFADML
CC(C)=CCSC[C@@H]([N-]S(=O)(=O)c1c(F)cccc1Cl)C(=O)[O-]	ZINC000547932263	564522509	/nfs/dbraw/zinc/52/25/09/564522509.db2.gz	ATWAESHFJZPCEG-GFCCVEGCSA-N	-2	1	381.878	2.910	20	0		GFADML
CC1([C@@H]([N-]S(=O)(=O)c2ccc(Br)o2)C(=O)[O-])CCCCC1	ZINC000548357718	564550431	/nfs/dbraw/zinc/55/04/31/564550431.db2.gz	AQZPJAXFNHKFJY-NSHDSACASA-N	-2	1	380.260	2.744	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)cc1NC(C)=O	ZINC000519216492	564571919	/nfs/dbraw/zinc/57/19/19/564571919.db2.gz	MVTWQEYPNGIJBK-UHFFFAOYSA-N	-2	1	384.435	2.523	20	0		GFADML
CC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)cc(Cl)c2)c(C(=O)[O-])c1	ZINC000572548356	564599444	/nfs/dbraw/zinc/59/94/44/564599444.db2.gz	GEOGJLPIEXJNEO-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000484967270	564603160	/nfs/dbraw/zinc/60/31/60/564603160.db2.gz	FVUTXPUZEFWRSY-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
O=C([O-])C[C@@H](C[N-]S(=O)(=O)c1csc(-c2ccccc2)n1)C(F)(F)F	ZINC000551997147	564672662	/nfs/dbraw/zinc/67/26/62/564672662.db2.gz	PYPIDLHQNUUECD-JTQLQIEISA-N	-2	1	394.396	2.742	20	0		GFADML
O=C([O-])[C@H](CC1CCC1)[N-]S(=O)(=O)c1cc(Br)c(F)cc1F	ZINC000530472748	564883803	/nfs/dbraw/zinc/88/38/03/564883803.db2.gz	YEGBSWVWHHNJMK-NSHDSACASA-N	-2	1	398.225	2.649	20	0		GFADML
O=C(N[C@]12C[C@H]1CCC2)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000617202038	565226742	/nfs/dbraw/zinc/22/67/42/565226742.db2.gz	KQOKLXWGOBXHOT-PIGZYNQJSA-N	-2	1	378.475	2.927	20	0		GFADML
Cc1nc(S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(F)F)c(-c2ccccc2)s1	ZINC000663291014	565407025	/nfs/dbraw/zinc/40/70/25/565407025.db2.gz	LMJPLMBGXNWBNB-LLVKDONJSA-N	-2	1	390.433	2.753	20	0		GFADML
COCCOCc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])sc2C)cc1	ZINC000629328222	565843940	/nfs/dbraw/zinc/84/39/40/565843940.db2.gz	QLGJFOXNLRRYBL-UHFFFAOYSA-N	-2	1	385.463	2.719	20	0		GFADML
O=C([O-])NCCCC(=O)Nc1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1	ZINC000739967296	599746431	/nfs/dbraw/zinc/74/64/31/599746431.db2.gz	TXUHPMMKNOCHDQ-UHFFFAOYSA-N	-2	1	395.412	2.613	20	0		GFADML
CCCC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000736986124	599767262	/nfs/dbraw/zinc/76/72/62/599767262.db2.gz	UBPAIOPDFYYSDU-KDOFPFPSSA-N	-2	1	385.464	2.881	20	0		GFADML
CCOCc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)OC)c2)c1	ZINC000737178110	599815742	/nfs/dbraw/zinc/81/57/42/599815742.db2.gz	PKHVILJIVQGQNL-UHFFFAOYSA-N	-2	1	393.417	2.509	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)ccc1C(=O)NC(C)C	ZINC000268665034	599907765	/nfs/dbraw/zinc/90/77/65/599907765.db2.gz	YFUHCWWTMSHDPE-UHFFFAOYSA-N	-2	1	390.461	2.941	20	0		GFADML
CCOc1ccc(S(=O)(=O)[N-]c2cc(OC)ccc2C(=O)[O-])cc1OCC	ZINC000512830309	600006124	/nfs/dbraw/zinc/00/61/24/600006124.db2.gz	YWIZVIYCGGTXRR-UHFFFAOYSA-N	-2	1	395.433	2.992	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1cccc([N-]S(=O)(=O)c2cc(C)ccc2C)c1	ZINC000262452349	600024878	/nfs/dbraw/zinc/02/48/78/600024878.db2.gz	RCPRYEVNCAUDMK-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc(NC(=O)C2CC2)cc1	ZINC000740143663	600094893	/nfs/dbraw/zinc/09/48/93/600094893.db2.gz	JRLNIJREYRWIKJ-UHFFFAOYSA-N	-2	1	378.381	2.673	20	0		GFADML
Cc1ccc(C(=O)NC2CC2)cc1[N-]S(=O)(=O)c1cc(F)ccc1C(=O)[O-]	ZINC000738514971	600096171	/nfs/dbraw/zinc/09/61/71/600096171.db2.gz	LENOAPQLXKQJKD-UHFFFAOYSA-N	-2	1	392.408	2.525	20	0		GFADML
Cn1cnc(S(=O)(=O)[N-][C@H](CC(=O)[O-])c2ccc(C(C)(C)C)cc2)c1Cl	ZINC000739048892	600452287	/nfs/dbraw/zinc/45/22/87/600452287.db2.gz	RDLHONVNJOGTRA-CYBMUJFWSA-N	-2	1	399.900	2.865	20	0		GFADML
CC(=O)N1CCc2ccc(S(=O)(=O)[N-]c3ccc(C(=O)[O-])c(Cl)c3)cc21	ZINC000522367704	600483356	/nfs/dbraw/zinc/48/33/56/600483356.db2.gz	WFCNJYZUYDXYTN-UHFFFAOYSA-N	-2	1	394.836	2.748	20	0		GFADML
CC(C)[C@H]1CCCN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)CC1	ZINC000736395954	600499313	/nfs/dbraw/zinc/49/93/13/600499313.db2.gz	SLONJEMNMCRILW-HNNXBMFYSA-N	-2	1	385.464	2.691	20	0		GFADML
CCCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)cc1	ZINC000042122795	600541334	/nfs/dbraw/zinc/54/13/34/600541334.db2.gz	LOHZVCHFTXMFEW-UHFFFAOYSA-N	-2	1	393.417	2.761	20	0		GFADML
O=C([O-])c1ccnc([N-]S(=O)(=O)/C=C/c2ccccc2Br)c1	ZINC000740248696	600577036	/nfs/dbraw/zinc/57/70/36/600577036.db2.gz	IHCWQRCAGVNUMH-SOFGYWHQSA-N	-2	1	383.223	2.955	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)ccc1C	ZINC000467079552	600817116	/nfs/dbraw/zinc/81/71/16/600817116.db2.gz	PDNXYTJRENSQRS-UHFFFAOYSA-N	-2	1	391.445	2.945	20	0		GFADML
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)c1	ZINC000610111304	600900508	/nfs/dbraw/zinc/90/05/08/600900508.db2.gz	SWZOXLJXBCLYKC-UHFFFAOYSA-N	-2	1	377.418	2.636	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cc(Cl)ccc2C(=O)[O-])n(-c2ccncc2)n1	ZINC000832900041	600988801	/nfs/dbraw/zinc/98/88/01/600988801.db2.gz	YSQBHDRACLINFC-UHFFFAOYSA-N	-2	1	392.824	2.728	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2ccc(Br)cc2C(=O)[O-])cc1O	ZINC000738633134	601117984	/nfs/dbraw/zinc/11/79/84/601117984.db2.gz	YTFYLYDITROGEY-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)[N-]S(=O)(=O)c1ccc(F)c(F)c1F	ZINC000548207400	601131712	/nfs/dbraw/zinc/13/17/12/601131712.db2.gz	JVIBUCDQFXGRNS-CYBMUJFWSA-N	-2	1	398.362	2.559	20	0		GFADML
CN(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1	ZINC000830518494	601232528	/nfs/dbraw/zinc/23/25/28/601232528.db2.gz	DRIGUIRZCCWZFQ-UHFFFAOYSA-N	-3	1	386.332	2.578	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(C(=O)CCC(=O)[O-])cc2)ccc1C(=O)[O-]	ZINC000481444435	601249786	/nfs/dbraw/zinc/24/97/86/601249786.db2.gz	FZXJZOXQMTZWNI-UHFFFAOYSA-N	-3	1	391.401	2.542	20	0		GFADML
COC(=O)/C=C/c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C(=O)[O-])cc1	ZINC000747609641	601323328	/nfs/dbraw/zinc/32/33/28/601323328.db2.gz	VXASJIOFLNDMBQ-RUDMXATFSA-N	-2	1	379.365	2.511	20	0		GFADML
COC(=O)C=Cc1ccc(S(=O)(=O)[N-]c2cccc(NC(=O)[O-])c2)cc1	ZINC000831124155	601324963	/nfs/dbraw/zinc/32/49/63/601324963.db2.gz	MDWSSYKJFPYLMQ-YFHOEESVSA-N	-2	1	376.390	2.764	20	0		GFADML
COC(=O)Nc1cc([N-]S(=O)(=O)c2ccc(C=CC(=O)[O-])cc2)ccc1F	ZINC000831206478	601329100	/nfs/dbraw/zinc/32/91/00/601329100.db2.gz	IDAMZZDDNOBHHL-WTKPLQERSA-N	-2	1	394.380	2.903	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(CN(C)C(=O)[O-])cc2)ccc1F	ZINC000831348470	601331753	/nfs/dbraw/zinc/33/17/53/601331753.db2.gz	RDCAYTSUBGQBLK-UHFFFAOYSA-N	-2	1	396.396	2.523	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)ccc1C	ZINC000831328762	601334469	/nfs/dbraw/zinc/33/44/69/601334469.db2.gz	YBBFPXWHFPOPNC-POHAHGRESA-N	-2	1	375.402	2.680	20	0		GFADML
CSc1nc(C)c(CCC(=O)N[C@H](c2ccccc2)[C@@H](C)C(=O)[O-])c(=O)[n-]1	ZINC000832794189	601392224	/nfs/dbraw/zinc/39/22/24/601392224.db2.gz	DXBQZRANMSFZEX-BZNIZROVSA-N	-2	1	389.477	2.723	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cccc(C(=O)NCC(C)(C)C(=O)[O-])c2)cc1	ZINC000262260940	601709569	/nfs/dbraw/zinc/70/95/69/601709569.db2.gz	SCYAWXNDPUTUJE-UHFFFAOYSA-N	-2	1	390.461	2.636	20	0		GFADML
CC[C@@H](NC(=O)c1ccc(C)c(S(=O)(=O)[N-]c2cccc(C)c2)c1)C(=O)[O-]	ZINC000262540750	601751993	/nfs/dbraw/zinc/75/19/93/601751993.db2.gz	VAMWMKYEGLEEIA-MRXNPFEDSA-N	-2	1	390.461	2.697	20	0		GFADML
COCCc1nc2cc([N-]S(=O)(=O)c3cc(C(=O)[O-])ccc3C)ccc2o1	ZINC000831795686	601795106	/nfs/dbraw/zinc/79/51/06/601795106.db2.gz	FVGIONSNRAMABC-UHFFFAOYSA-N	-2	1	390.417	2.824	20	0		GFADML
CC1(C)C(=O)Nc2ccc(S(=O)(=O)[N-]c3cccc(F)c3C(=O)[O-])cc21	ZINC000531522465	601840334	/nfs/dbraw/zinc/84/03/34/601840334.db2.gz	VUUIQEXMZJRKAY-UHFFFAOYSA-N	-2	1	378.381	2.554	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1ccc(OC[C@H]2CCCO2)cc1	ZINC000833295284	601858625	/nfs/dbraw/zinc/85/86/25/601858625.db2.gz	UQJPHJCOLQWAMU-CQSZACIVSA-N	-2	1	395.408	2.883	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2cc(NC(=O)CCNC(=O)[O-])ccc2C)c1	ZINC000738736471	602072643	/nfs/dbraw/zinc/07/26/43/602072643.db2.gz	NDVBOIRLELCYTQ-UHFFFAOYSA-N	-2	1	391.449	2.700	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C(C)(C)C(=O)[O-])cc2)ccc1[O-]	ZINC000481593245	602199825	/nfs/dbraw/zinc/19/98/25/602199825.db2.gz	CIHSQXBIKDGQNS-UHFFFAOYSA-N	-2	1	392.433	2.514	20	0		GFADML
O=C([O-])CCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCN3C(=O)[O-])cc1	ZINC000740481658	602246758	/nfs/dbraw/zinc/24/67/58/602246758.db2.gz	ICMKTCAVLZQZJV-UHFFFAOYSA-N	-3	1	390.417	2.545	20	0		GFADML
Cc1ccc([N-]S(=O)(=O)c2cc(C(=O)OCCNC(=O)[O-])ccc2C)cc1	ZINC000832952982	602257510	/nfs/dbraw/zinc/25/75/10/602257510.db2.gz	PYUNBGUXMFWIMG-UHFFFAOYSA-N	-2	1	392.433	2.529	20	0		GFADML
Cc1cccc(S(=O)(=O)[N-]c2cccc(C(=O)CCC(=O)[O-])c2)c1C(=O)[O-]	ZINC000832973174	602309896	/nfs/dbraw/zinc/30/98/96/602309896.db2.gz	YEZZTCLXQGNWPQ-UHFFFAOYSA-N	-3	1	391.401	2.542	20	0		GFADML
CCC[C@H](NC(=O)[O-])C(=O)Nc1cccc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000739324863	602395229	/nfs/dbraw/zinc/39/52/29/602395229.db2.gz	FRJISWRVWTXGAL-INIZCTEOSA-N	-2	1	391.449	2.862	20	0		GFADML
CCC[C@@H](NC(=O)[O-])C(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000739324209	602396972	/nfs/dbraw/zinc/39/69/72/602396972.db2.gz	ZBHVFDSWSHMQGJ-MRXNPFEDSA-N	-2	1	391.449	2.862	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCN3C(=O)[O-])cc1OC	ZINC000739932857	602646559	/nfs/dbraw/zinc/64/65/59/602646559.db2.gz	MXUHLRAEUKAMKK-UHFFFAOYSA-N	-2	1	392.433	2.935	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCN3C(=O)[O-])c1	ZINC000740717496	602646703	/nfs/dbraw/zinc/64/67/03/602646703.db2.gz	WHGXVKQZJVBCIW-UHFFFAOYSA-N	-3	1	376.390	2.616	20	0		GFADML
CCN(Cc1cccc([N-]S(=O)(=O)c2ccc3c(c2)C(=O)OC3)c1)C(=O)[O-]	ZINC000739447440	602654458	/nfs/dbraw/zinc/65/44/58/602654458.db2.gz	PVVFLLPTYPRQLU-UHFFFAOYSA-N	-2	1	390.417	2.658	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2ccc(CN3CCCC3=O)cc2)c([O-])c1	ZINC000740699318	602853968	/nfs/dbraw/zinc/85/39/68/602853968.db2.gz	XWGBGPVADRGNLL-UHFFFAOYSA-N	-2	1	383.404	2.535	20	0		GFADML
CN(C[C@@H]1CCN(C(=O)c2ccc(NC(=O)[O-])cc2[O-])C1)C(=O)OC(C)(C)C	ZINC000739658144	602860399	/nfs/dbraw/zinc/86/03/99/602860399.db2.gz	XABPGPJSLZFLHX-LBPRGKRZSA-N	-2	1	393.440	2.811	20	0		GFADML
C[C@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])CC[C@H]1NC(=O)[O-]	ZINC000739164391	602869096	/nfs/dbraw/zinc/86/90/96/602869096.db2.gz	CPQGHWYSRYGEJK-SMDDNHRTSA-N	-2	1	393.440	2.857	20	0		GFADML
O=C([O-])N1CCC[C@@H]1C1CCN(Cn2[n-]c(-c3ccccn3)nc2=S)CC1	ZINC000740514259	602992279	/nfs/dbraw/zinc/99/22/79/602992279.db2.gz	BXUPRTRZVPUKFP-OAHLLOKOSA-N	-2	1	388.497	2.815	20	0		GFADML
O=C([O-])N1CCC[C@H]1C(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1	ZINC000740465139	603234911	/nfs/dbraw/zinc/23/49/11/603234911.db2.gz	NESDAZJSTPJDSH-INIZCTEOSA-N	-2	1	389.433	2.568	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc([C@@H](C)NC(=O)[O-])cc1	ZINC000830957215	603403708	/nfs/dbraw/zinc/40/37/08/603403708.db2.gz	MNGMBJGAEXGWTO-MRVPVSSYSA-N	-3	1	384.435	2.884	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)NCc2nccn2CCc2ccccc2)c([O-])c1	ZINC000832833253	603558892	/nfs/dbraw/zinc/55/88/92/603558892.db2.gz	JYMXFJUGEGSVPB-UHFFFAOYSA-N	-2	1	380.404	2.851	20	0		GFADML
CCCC[C@@H](CNC(=O)[O-])NC(=O)N1CCC(C(=O)c2ccc([O-])cc2)CC1	ZINC000826789696	603889725	/nfs/dbraw/zinc/88/97/25/603889725.db2.gz	XOEDSBWLJMBUEJ-INIZCTEOSA-N	-2	1	391.468	2.823	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CC(OCCCOc3ccccc3)C2)c([O-])c1	ZINC000832829284	603956206	/nfs/dbraw/zinc/95/62/06/603956206.db2.gz	REJKUVNYLIPLQM-UHFFFAOYSA-N	-2	1	386.404	2.792	20	0		GFADML
C[C@]([N-]S(=O)(=O)c1cc(Br)sc1Cl)(C(=O)[O-])C1CC1	ZINC000827747409	604810693	/nfs/dbraw/zinc/81/06/93/604810693.db2.gz	NOIPSJHBERVYGU-SNVBAGLBSA-N	-2	1	388.692	2.696	20	0		GFADML
CCC[C@H](NC(=O)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)cc1)C(=O)[O-]	ZINC000680364206	605022993	/nfs/dbraw/zinc/02/29/93/605022993.db2.gz	LKQFNMJNNJFUDP-INIZCTEOSA-N	-2	1	394.424	2.610	20	0		GFADML
CC(=O)N(C)c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C(=O)[O-])cc1	ZINC000833388127	605167271	/nfs/dbraw/zinc/16/72/71/605167271.db2.gz	IUQKKWIRLHRNFN-UHFFFAOYSA-N	-2	1	382.825	2.822	20	0		GFADML
CCNC(=O)Nc1cccc([N-]S(=O)(=O)c2ccc(C)cc2C(=O)[O-])c1	ZINC000833657555	605185392	/nfs/dbraw/zinc/18/53/92/605185392.db2.gz	RVGRIPBXSVBOQY-UHFFFAOYSA-N	-2	1	377.422	2.635	20	0		GFADML
COc1cc(OC)cc(S(=O)(=O)[N-]c2ccc3c(c2)CN(C(=O)[O-])CC3)c1	ZINC000829217232	605237693	/nfs/dbraw/zinc/23/76/93/605237693.db2.gz	LLVIFFFBBHSQRN-UHFFFAOYSA-N	-2	1	392.433	2.541	20	0		GFADML
Cc1cc(Br)c([O-])c(NC(=O)CO[C@@H]2CCCN(C(=O)[O-])C2)c1	ZINC000833898915	605472651	/nfs/dbraw/zinc/47/26/51/605472651.db2.gz	WWVFNYZOYVSOCN-SNVBAGLBSA-N	-2	1	387.230	2.561	20	0		GFADML
O=C([O-])NC1C[C@H]2CCC[C@@H](C1)N2C(=O)c1ccc(Br)cc1[O-]	ZINC000834162021	605657494	/nfs/dbraw/zinc/65/74/94/605657494.db2.gz	MXPKSMXNONGOOM-YOGCLGLASA-N	-2	1	383.242	2.948	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)c([O-])c1	ZINC000834255860	605666234	/nfs/dbraw/zinc/66/62/34/605666234.db2.gz	IHFZXZAQJOHRRJ-NHYWBVRUSA-N	-2	1	378.331	2.708	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2[O-])[C@H](C)CN1C(=O)[O-]	ZINC000833835703	605837507	/nfs/dbraw/zinc/83/75/07/605837507.db2.gz	CSFJCDPPNAHFFE-VXGBXAGGSA-N	-2	1	393.440	2.952	20	0		GFADML
COc1ccc(-c2nc(SC/C=C/Cl)[n-]c(=O)c2-c2nnn[n-]2)cc1	ZINC000821733030	607160918	/nfs/dbraw/zinc/16/09/18/607160918.db2.gz	YLOUNGDYRADPKC-FARCUNLSSA-N	-2	1	376.829	2.883	20	0		GFADML
Cc1[nH]nc([N-]S(=O)(=O)c2csc3ccc(Cl)cc23)c1-c1nn[n-]n1	ZINC000826322407	660453122	/nfs/dbraw/zinc/45/31/22/660453122.db2.gz	LEFFFVAOJSIPOG-UHFFFAOYSA-N	-2	1	395.857	2.567	20	0		GFADML
COc1cccc([N-]S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)c1	ZINC000013345391	654504568	/nfs/dbraw/zinc/50/45/68/654504568.db2.gz	MUKUROZEOCJYEY-UHFFFAOYSA-N	-2	1	386.223	2.957	20	0		GFADML
O=C(N[N-]S(=O)(=O)c1c(Cl)cccc1Cl)c1ccc(Cl)cc1[O-]	ZINC000055664992	654780080	/nfs/dbraw/zinc/78/00/80/654780080.db2.gz	ZCPUTZAECRNLCR-UHFFFAOYSA-N	-2	1	395.651	2.976	20	0		GFADML
CC[C@H]([N-]S(=O)(=O)c1cc(C(=O)[O-])c(F)cc1Br)C(F)F	ZINC000840890330	661199636	/nfs/dbraw/zinc/19/96/36/661199636.db2.gz	KNXMQVCZYVIDNX-QMMMGPOBSA-N	-2	1	390.177	2.608	20	0		GFADML
Cc1ccc(F)c([N-]S(=O)(=O)c2c(Cl)nc3ccccn32)c1C(=O)[O-]	ZINC000761281162	656007724	/nfs/dbraw/zinc/00/77/24/656007724.db2.gz	JITOWWPQOGXMJM-UHFFFAOYSA-N	-2	1	383.788	2.934	20	0		GFADML
C[S@](=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)c1	ZINC000767736259	656217607	/nfs/dbraw/zinc/21/76/07/656217607.db2.gz	IAVAYTNLTGBBKT-QHCPKHFHSA-N	-2	1	391.829	2.716	20	0		GFADML
O=C([O-])[C@@H]([N-]S(=O)(=O)c1c(Cl)ccnc1Cl)c1cc(F)ccc1F	ZINC000776503304	656748676	/nfs/dbraw/zinc/74/86/76/656748676.db2.gz	AMZHEZIKWABFDS-JTQLQIEISA-N	-2	1	397.186	2.771	20	0		GFADML
O=C([O-])c1cccc(S(=O)(=O)[N-]c2ccccc2[C@@H](O)C(F)(F)F)c1	ZINC000777745501	656834213	/nfs/dbraw/zinc/83/42/13/656834213.db2.gz	YVKPBYMKXDWIPZ-CYBMUJFWSA-N	-2	1	375.324	2.781	20	0		GFADML
O=C(NOCC1CCC1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000856345930	662030540	/nfs/dbraw/zinc/03/05/40/662030540.db2.gz	MIKDRGXAMYKYSY-UHFFFAOYSA-N	-2	1	382.463	2.716	20	0		GFADML
C[C@@H]1CC[C@@H](C(=O)[O-])C[C@H]1[N-]S(=O)(=O)c1sccc1Br	ZINC000871771915	662733251	/nfs/dbraw/zinc/73/32/51/662733251.db2.gz	TVOIBXTYDDKKRR-NQMVMOMDSA-N	-2	1	382.301	2.678	20	0		GFADML
CC(C)(C)[C@H]1C[C@H]([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(F)c2F)CCO1	ZINC000871929665	662743228	/nfs/dbraw/zinc/74/32/28/662743228.db2.gz	FMBHGCPVNRZTFG-ZWNOBZJWSA-N	-2	1	377.409	2.535	20	0		GFADML
O=C(c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-])N1CC[C@H](CF)C1	ZINC000881666067	662999150	/nfs/dbraw/zinc/99/91/50/662999150.db2.gz	SZZAZEKJDXTINB-LLVKDONJSA-N	-2	1	384.454	2.686	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2c(C)nn(C)c2Cl)c(Cl)cc1C(=O)[O-]	ZINC000917846248	664490929	/nfs/dbraw/zinc/49/09/29/664490929.db2.gz	UCVCFLXOHDHSEE-UHFFFAOYSA-N	-2	1	394.236	2.543	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2ccc(Cl)s2)cc1[N-]S(C)(=O)=O	ZINC000044259429	551143536	/nfs/dbraw/zinc/14/35/36/551143536.db2.gz	YZEJQPUOZXQAPV-UHFFFAOYSA-N	-2	1	396.899	2.582	20	0		GFADML
COc1cc(S(=O)(=O)[N-]c2cc(F)cc(Cl)c2)cc(C(=O)[O-])c1OC	ZINC000328180496	563461032	/nfs/dbraw/zinc/46/10/32/563461032.db2.gz	LVNKSZJXBICRMI-UHFFFAOYSA-N	-2	1	389.788	2.995	20	0		GFADML
CC(C)(C)OC[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)C(=O)[O-]	ZINC000284934803	563495309	/nfs/dbraw/zinc/49/53/09/563495309.db2.gz	CMOGVBODGDQOIS-LURJTMIESA-N	-2	1	376.283	2.602	20	0		GFADML
Cc1c(Br)cc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(O)c1	ZINC000387693235	563519650	/nfs/dbraw/zinc/51/96/50/563519650.db2.gz	GLMFWLJQZUZWBG-UHFFFAOYSA-N	-2	1	386.223	2.962	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c(F)c1	ZINC000392976951	563527872	/nfs/dbraw/zinc/52/78/72/563527872.db2.gz	SUSXJSICRFINAK-UHFFFAOYSA-N	-2	1	386.788	2.937	20	0		GFADML
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cs2)c1Cl	ZINC000431179132	563555779	/nfs/dbraw/zinc/55/57/79/563555779.db2.gz	LYNIOOKCWQFLFO-UHFFFAOYSA-N	-2	1	375.811	2.687	20	0		GFADML
COc1cc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])c(C)c2)ccc1Cl	ZINC000432473759	563585024	/nfs/dbraw/zinc/58/50/24/563585024.db2.gz	UMGYPUIUQGQNAD-UHFFFAOYSA-N	-2	1	385.825	2.921	20	0		GFADML
COc1ccc(Br)c(C(=O)[O-])c1[N-]S(=O)(=O)CCCCF	ZINC000287662263	563612792	/nfs/dbraw/zinc/61/27/92/563612792.db2.gz	VLNJLMFTXHJVEE-UHFFFAOYSA-N	-2	1	384.223	2.647	20	0		GFADML
O=C(N[C@@H]1CC[C@H](F)C1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436744172	563678862	/nfs/dbraw/zinc/67/88/62/563678862.db2.gz	KBOLLTXNGLFZIN-WDEREUQCSA-N	-2	1	384.454	2.875	20	0		GFADML
O=C(NC1CC(F)(F)C1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1[O-]	ZINC000436882735	563683994	/nfs/dbraw/zinc/68/39/94/563683994.db2.gz	VLPVGXFSLZVDAO-UHFFFAOYSA-N	-2	1	388.417	2.782	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(Cl)c2)ccc1C	ZINC000476395675	564337718	/nfs/dbraw/zinc/33/77/18/564337718.db2.gz	YACUNDJAMABVQD-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
O=C([O-])c1cc(Br)cc(S(=O)(=O)[N-]c2cccc3c2CCO3)c1	ZINC000478693741	564411828	/nfs/dbraw/zinc/41/18/28/564411828.db2.gz	AWSDWVJWGWNXPT-UHFFFAOYSA-N	-2	1	398.234	2.883	20	0		GFADML
O=C([O-])[C@H](C[N-]S(=O)(=O)c1cc(Cl)sc1Cl)Cc1ccccn1	ZINC000547879130	564515417	/nfs/dbraw/zinc/51/54/17/564515417.db2.gz	NMSDTGISWBKILC-QMMMGPOBSA-N	-2	1	395.289	2.672	20	0		GFADML
CSCc1cccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)c1	ZINC000517593221	564537558	/nfs/dbraw/zinc/53/75/58/564537558.db2.gz	WAPCGWYUFKIOBX-UHFFFAOYSA-N	-3	1	381.431	2.747	20	0		GFADML
COC(=O)Cc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])c1	ZINC000571371181	564548654	/nfs/dbraw/zinc/54/86/54/564548654.db2.gz	XNNGMKPBZPNBIL-UHFFFAOYSA-N	-2	1	383.809	2.555	20	0		GFADML
C[C@@H]1CC[C@@](C[N-]S(=O)(=O)c2ccc(Br)o2)(CC(=O)[O-])C1	ZINC000548547316	564558543	/nfs/dbraw/zinc/55/85/43/564558543.db2.gz	CISIXVHYHQCYHS-RNCFNFMXSA-N	-2	1	380.260	2.602	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(C[S@](C)=O)c1C	ZINC000522597203	564652731	/nfs/dbraw/zinc/65/27/31/564652731.db2.gz	UJEKBPIXWORMHG-QHCPKHFHSA-N	-2	1	387.504	2.742	20	0		GFADML
Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-]C[C@@H](CC(=O)[O-])C(F)(F)F	ZINC000551997466	564672263	/nfs/dbraw/zinc/67/22/63/564672263.db2.gz	IZPGWHZUPPRALA-MRVPVSSYSA-N	-2	1	383.319	2.812	20	0		GFADML
C[C@@H](C(=O)[O-])[C@H](C)[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br	ZINC000574534702	564678318	/nfs/dbraw/zinc/67/83/18/564678318.db2.gz	WUHORZPHUHNPMD-RITPCOANSA-N	-2	1	388.642	2.629	20	0		GFADML
CC[C@@H]([N-]S(=O)(=O)c1csnc1C(=O)[O-])c1ccccc1OC(F)F	ZINC000574753900	564687239	/nfs/dbraw/zinc/68/72/39/564687239.db2.gz	DZAAJSGSIPVXCR-SECBINFHSA-N	-2	1	392.405	2.872	20	0		GFADML
O=C([O-])[C@H]1C=C[C@H]([N-]S(=O)(=O)c2cc(Cl)c(Br)cc2F)C1	ZINC000530354203	564877864	/nfs/dbraw/zinc/87/78/64/564877864.db2.gz	YVGPARGZXIZRAO-BQBZGAKWSA-N	-2	1	398.637	2.549	20	0		GFADML
COc1cc(F)c(S(=O)(=O)[N-][C@H]2C[C@@H](CCC(=O)[O-])C2(C)C)c(F)c1	ZINC000657143486	565077402	/nfs/dbraw/zinc/07/74/02/565077402.db2.gz	XEKCISZHYSHTDF-RNCFNFMXSA-N	-2	1	377.409	2.531	20	0		GFADML
Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)N(C)[C@@H](C)C(=O)[O-])cc2)c1C	ZINC000263328389	597464882	/nfs/dbraw/zinc/46/48/82/597464882.db2.gz	UCKSZAVSEOXHDR-AWEZNQCLSA-N	-2	1	390.461	2.649	20	0		GFADML
CN(CCC1CCCCC1)C(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1	ZINC000737415505	599704309	/nfs/dbraw/zinc/70/43/09/599704309.db2.gz	PBBAJGRXNZEIEA-UHFFFAOYSA-N	-2	1	385.464	2.835	20	0		GFADML
O=C([O-])CCc1ccc([N-]S(=O)(=O)c2cc(C(=O)[O-])cc3c2CCC3)cc1	ZINC000739767024	599853876	/nfs/dbraw/zinc/85/38/76/599853876.db2.gz	QJSAYFVLEOUVGP-UHFFFAOYSA-N	-3	1	389.429	2.692	20	0		GFADML
CCNC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)c1	ZINC000477412087	599906259	/nfs/dbraw/zinc/90/62/59/599906259.db2.gz	KWIGCTPWBOHYQK-UHFFFAOYSA-N	-2	1	376.434	2.552	20	0		GFADML
Cc1c(C(=O)[O-])cccc1S(=O)(=O)[N-]c1ccc(C(=O)NC(C)C)cc1	ZINC000477416493	599907112	/nfs/dbraw/zinc/90/71/12/599907112.db2.gz	USBVACJOAVLYHL-UHFFFAOYSA-N	-2	1	376.434	2.632	20	0		GFADML
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1cccc(CSCC(=O)[O-])c1	ZINC000738546229	599927567	/nfs/dbraw/zinc/92/75/67/599927567.db2.gz	OKVRIVAEJQMRMO-UHFFFAOYSA-N	-3	1	395.458	2.812	20	0		GFADML
O=C([O-])[C@@H](CNC(=O)c1ccc(Br)cc1[O-])Cc1cccc(F)c1	ZINC000739409222	599984071	/nfs/dbraw/zinc/98/40/71/599984071.db2.gz	UIHYNHBQJGNFFT-LLVKDONJSA-N	-2	1	396.212	2.967	20	0		GFADML
CCN(CC(=O)[O-])C(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)cc1	ZINC000262485903	600024834	/nfs/dbraw/zinc/02/48/34/600024834.db2.gz	WNJXRZHDACXFOB-UHFFFAOYSA-N	-2	1	390.461	2.651	20	0		GFADML
CC(C)[C@H]1CCC[C@H](NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)C1	ZINC000736394126	600077942	/nfs/dbraw/zinc/07/79/42/600077942.db2.gz	GMBXZSDSGBLBTL-HOTGVXAUSA-N	-2	1	385.464	2.737	20	0		GFADML
CC(C)C(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])cc1	ZINC000736346915	600093069	/nfs/dbraw/zinc/09/30/69/600093069.db2.gz	CFSNTGUIAVJFNF-UHFFFAOYSA-N	-2	1	380.397	2.919	20	0		GFADML
O=C([O-])c1ccc(F)cc1S(=O)(=O)[N-]c1ccc2c(c1)OC(F)(F)O2	ZINC000740143046	600094780	/nfs/dbraw/zinc/09/47/80/600094780.db2.gz	APZVREAPSSWFSV-UHFFFAOYSA-N	-2	1	375.280	2.646	20	0		GFADML
CCC(=O)Nc1ccc(C)c([N-]S(=O)(=O)c2cc(F)ccc2C(=O)[O-])c1	ZINC000736847754	600095964	/nfs/dbraw/zinc/09/59/64/600095964.db2.gz	NKWWZTRINDPHQY-UHFFFAOYSA-N	-2	1	380.397	2.982	20	0		GFADML
Cc1nc2cc(=O)[n-]n2c(C)c1CCC(=O)OCc1ccc(F)cc1C(=O)[O-]	ZINC000738876531	600116513	/nfs/dbraw/zinc/11/65/13/600116513.db2.gz	XLDGGVXTVDEZOW-UHFFFAOYSA-N	-2	1	387.367	2.565	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)c(C(=O)[O-])[nH]1	ZINC000738463859	600255902	/nfs/dbraw/zinc/25/59/02/600255902.db2.gz	YGCIJGYYZJBTPM-UHFFFAOYSA-N	-2	1	379.438	2.807	20	0		GFADML
CC(C)(NC(=O)c1ccc(-n2[n-]c(CC(=O)[O-])cc2=O)cc1)c1cccs1	ZINC000736339158	600259259	/nfs/dbraw/zinc/25/92/59/600259259.db2.gz	LTUVZYZKRTXMFJ-UHFFFAOYSA-N	-2	1	385.445	2.519	20	0		GFADML
CC(C)(CCC(=O)[O-])NC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1	ZINC000262674092	600385023	/nfs/dbraw/zinc/38/50/23/600385023.db2.gz	YAGNJFYFHCCAFL-UHFFFAOYSA-N	-2	1	390.461	2.861	20	0		GFADML
CC(=O)NCCc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])c(Cl)c2)cc1	ZINC000063180361	600482601	/nfs/dbraw/zinc/48/26/01/600482601.db2.gz	ZIYFVHACYZXDSI-UHFFFAOYSA-N	-2	1	396.852	2.518	20	0		GFADML
CCc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])c(F)cc2F)c(C(=O)[O-])c1	ZINC000737266383	600536262	/nfs/dbraw/zinc/53/62/62/600536262.db2.gz	LIHRFNZVBCYKPA-UHFFFAOYSA-N	-2	1	385.344	2.724	20	0		GFADML
CC(=O)N1CCc2ccc(S(=O)(=O)[N-]c3ccc(N(C)C(=O)[O-])cc3)cc21	ZINC000736140042	600612527	/nfs/dbraw/zinc/61/25/27/600612527.db2.gz	UXKHFTAPJQEEAC-UHFFFAOYSA-N	-2	1	389.433	2.511	20	0		GFADML
CC(=O)Nc1cc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)ccc1C	ZINC000736161433	600635395	/nfs/dbraw/zinc/63/53/95/600635395.db2.gz	RISXQSHJRKXAKT-UHFFFAOYSA-N	-2	1	376.434	2.771	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2c[nH]c(C(=O)[O-])c2)ccc1NC(=O)c1ccco1	ZINC000509594359	600677794	/nfs/dbraw/zinc/67/77/94/600677794.db2.gz	DXGISRVHOKWNPB-UHFFFAOYSA-N	-2	1	389.389	2.667	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)ccc1C(=O)[O-]	ZINC000831328300	600687961	/nfs/dbraw/zinc/68/79/61/600687961.db2.gz	UORFOYZVWMKJRU-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc3ncccc3c2)cc1C(=O)[O-]	ZINC000831435307	600690083	/nfs/dbraw/zinc/69/00/83/600690083.db2.gz	UOLTYHKYGFRTEE-UHFFFAOYSA-N	-2	1	386.385	2.520	20	0		GFADML
CCn1cnnc1-c1cccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000032096048	600810218	/nfs/dbraw/zinc/81/02/18/600810218.db2.gz	SJXHVLCLFHRIRV-UHFFFAOYSA-N	-2	1	386.433	2.772	20	0		GFADML
CCCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc1	ZINC000055665734	600811620	/nfs/dbraw/zinc/81/16/20/600811620.db2.gz	NLFLIQQOYPYWPJ-UHFFFAOYSA-N	-2	1	376.434	2.634	20	0		GFADML
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)N(C)C)c(Cl)c2)cc1C(=O)[O-]	ZINC000057125323	600812334	/nfs/dbraw/zinc/81/23/34/600812334.db2.gz	KQGVIYZLNHURPO-UHFFFAOYSA-N	-2	1	396.852	2.849	20	0		GFADML
Cn1cc(S(=O)(=O)[N-]c2cccc(C[S@@](=O)C(C)(C)C)c2)cc1C(=O)[O-]	ZINC000265280658	600815282	/nfs/dbraw/zinc/81/52/82/600815282.db2.gz	OOCZMLIHCXOUKR-RUZDIDTESA-N	-2	1	398.506	2.571	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(CCC(=O)[O-])cc2)ccc1C	ZINC000831348439	600817016	/nfs/dbraw/zinc/81/70/16/600817016.db2.gz	NFXXNXAZTJERLN-UHFFFAOYSA-N	-2	1	377.418	2.600	20	0		GFADML
CC(C)(C(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3[nH]c(=O)oc3c2)cc1	ZINC000525329724	600899518	/nfs/dbraw/zinc/89/95/18/600899518.db2.gz	MYKDLECXUJQRHH-UHFFFAOYSA-N	-2	1	376.390	2.696	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)cc1OC	ZINC000265806725	600900088	/nfs/dbraw/zinc/90/00/88/600900088.db2.gz	YKNAGHUMULFBGH-UHFFFAOYSA-N	-2	1	379.434	2.867	20	0		GFADML
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C(=O)[O-])cc2)cc1	ZINC000607030505	600900149	/nfs/dbraw/zinc/90/01/49/600900149.db2.gz	BIXJYOFRESIHCM-UHFFFAOYSA-N	-2	1	376.434	2.808	20	0		GFADML
C[C@@H]1CN(C(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)[C@@H]1c1ccccc1	ZINC000828394950	600936955	/nfs/dbraw/zinc/93/69/55/600936955.db2.gz	URKPEEDVGAHENC-SZNDQCEHSA-N	-2	1	391.427	2.626	20	0		GFADML
C[C@H]([N-]S(=O)(=O)c1ccc(C(=O)[O-])o1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000827756203	600988276	/nfs/dbraw/zinc/98/82/76/600988276.db2.gz	YOAOFZWEWYLARG-QMMMGPOBSA-N	-2	1	397.796	2.721	20	0		GFADML
Cc1ccccc1-c1cc([N-]S(=O)(=O)c2ccc(OCC(=O)[O-])cc2)[nH]n1	ZINC000444422158	601241019	/nfs/dbraw/zinc/24/10/19/601241019.db2.gz	KIOMKEMWOXIDDU-UHFFFAOYSA-N	-2	1	387.417	2.649	20	0		GFADML
COC(=O)c1cc([N-]S(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)ccc1F	ZINC000026235823	601319811	/nfs/dbraw/zinc/31/98/11/601319811.db2.gz	BOIKLELLBBZMPG-RUDMXATFSA-N	-2	1	379.365	2.511	20	0		GFADML
CCCNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1	ZINC000829519532	601326108	/nfs/dbraw/zinc/32/61/08/601326108.db2.gz	LQPBGVBYBADEOZ-XGICHPGQSA-N	-2	1	388.445	2.725	20	0		GFADML
COC(=O)c1ccc([N-]S(=O)(=O)c2cccc3c2CCCC3)cc1C(=O)[O-]	ZINC000831435456	601475134	/nfs/dbraw/zinc/47/51/34/601475134.db2.gz	XSJSAVWUHPQONG-UHFFFAOYSA-N	-2	1	389.429	2.851	20	0		GFADML
CCCOc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)[O-])cc1	ZINC000443365995	601575725	/nfs/dbraw/zinc/57/57/25/601575725.db2.gz	SPYJPUHERMVAJW-UHFFFAOYSA-N	-2	1	379.390	2.673	20	0		GFADML
Cc1cc([C@@H](C)NC(=O)c2ccc(-n3[n-]c(CC(=O)[O-])cc3=O)cc2)ccc1F	ZINC000832871138	601748130	/nfs/dbraw/zinc/74/81/30/601748130.db2.gz	OQCGRKPVMWYTGT-CYBMUJFWSA-N	-2	1	397.406	2.731	20	0		GFADML
COC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(F)c(F)c(C(=O)[O-])c2)cc1	ZINC000751145918	601835427	/nfs/dbraw/zinc/83/54/27/601835427.db2.gz	MCODDKUNDNSRNX-UHFFFAOYSA-N	-2	1	386.332	2.642	20	0		GFADML
O=C([O-])c1c(F)cccc1S(=O)(=O)[N-]c1cccc(OC[C@H]2CCCO2)c1	ZINC000833293824	601858433	/nfs/dbraw/zinc/85/84/33/601858433.db2.gz	ANUBSWCZIFIJEX-CQSZACIVSA-N	-2	1	395.408	2.883	20	0		GFADML
O=C([O-])NCCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1	ZINC000739948842	602028062	/nfs/dbraw/zinc/02/80/62/602028062.db2.gz	ZZPWGGWQXSBZIO-UHFFFAOYSA-N	-2	1	397.840	2.737	20	0		GFADML
Cc1ccc(NC(=O)[C@@H](C)CC(=O)[O-])cc1[N-]S(=O)(=O)c1ccccc1	ZINC000832943008	602097969	/nfs/dbraw/zinc/09/79/69/602097969.db2.gz	LFBDPVFMMLMPFB-ZDUSSCGKSA-N	-2	1	376.434	2.845	20	0		GFADML
CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2ccc(OCCC(=O)[O-])cc2)[nH]n1	ZINC000829216512	602102193	/nfs/dbraw/zinc/10/21/93/602102193.db2.gz	NLPAKQFIAIRVLI-GFCCVEGCSA-N	-2	1	381.454	2.968	20	0		GFADML
CCCCN1CCc2ccc([N-]S(=O)(=O)c3cc(C(=O)[O-])n(C)c3)cc21	ZINC000471127861	602105607	/nfs/dbraw/zinc/10/56/07/602105607.db2.gz	TVPAIPNBGQRYTD-UHFFFAOYSA-N	-2	1	377.466	2.687	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2cc(C3CCCCC3)n[nH]2)cc1C(=O)[O-]	ZINC000832468515	602307880	/nfs/dbraw/zinc/30/78/80/602307880.db2.gz	GGEWWWOWAHZKPM-UHFFFAOYSA-N	-2	1	379.438	2.965	20	0		GFADML
CC(C)(NC(=O)[O-])c1noc(COC(=O)c2ccc(Cl)c(Cl)c2[O-])n1	ZINC000738758071	602462447	/nfs/dbraw/zinc/46/24/47/602462447.db2.gz	QQGBBBVKFUCNFO-UHFFFAOYSA-N	-2	1	390.179	2.942	20	0		GFADML
CCOC(=O)c1cccc(S(=O)(=O)[N-]c2ccccc2CN(C)C(=O)[O-])c1	ZINC000739479505	602654316	/nfs/dbraw/zinc/65/43/16/602654316.db2.gz	QGCVMIHYVZTDPF-UHFFFAOYSA-N	-2	1	392.433	2.774	20	0		GFADML
CCS(=O)(=O)[N-]c1ccccc1C(=O)Nc1cc(NC(=O)[O-])ccc1F	ZINC000739519734	602783353	/nfs/dbraw/zinc/78/33/53/602783353.db2.gz	SWNAXCIWARPVJI-UHFFFAOYSA-N	-2	1	381.385	2.930	20	0		GFADML
O=C([O-])Nc1ccc(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)c([O-])c1	ZINC000740700159	602857930	/nfs/dbraw/zinc/85/79/30/602857930.db2.gz	RJVLQDYESHCKRC-UHFFFAOYSA-N	-2	1	389.452	2.737	20	0		GFADML
CC(C)(C)[N-]S(=O)(=O)c1ccc(C(=O)Oc2ccc(NC(=O)[O-])cc2)o1	ZINC000737578510	602962167	/nfs/dbraw/zinc/96/21/67/602962167.db2.gz	JUVFSJHDNSOPCZ-UHFFFAOYSA-N	-2	1	382.394	2.666	20	0		GFADML
CN(CCCC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2)cc1)C(=O)[O-]	ZINC000737430859	603233439	/nfs/dbraw/zinc/23/34/39/603233439.db2.gz	LSUSOJILSZMTSU-UHFFFAOYSA-N	-2	1	391.449	2.816	20	0		GFADML
O=C([O-])Nc1ccc([N-]S(=O)(=O)c2ccc(N3CCOC3=O)cc2)cc1	ZINC000738665690	603261066	/nfs/dbraw/zinc/26/10/66/603261066.db2.gz	AMNACVSFDZFKCW-UHFFFAOYSA-N	-2	1	377.378	2.534	20	0		GFADML
C[C@H](NC(=O)[O-])c1ccc([N-]S(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1	ZINC000825448074	603402457	/nfs/dbraw/zinc/40/24/57/603402457.db2.gz	AYILITSBVBJGDZ-NSHDSACASA-N	-2	1	388.401	2.922	20	0		GFADML
Cc1nc(C(C)C)[n-]c(=O)c1C(=O)N1CCC[C@@H]([C@H]2CCCN2C(=O)[O-])C1	ZINC000830709544	603481361	/nfs/dbraw/zinc/48/13/61/603481361.db2.gz	LPWXODXPKNYQNV-ZIAGYGMSSA-N	-2	1	376.457	2.609	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2ccccc2CN(C)C(=O)[O-])ccc1C	ZINC000828761611	603544503	/nfs/dbraw/zinc/54/45/03/603544503.db2.gz	XKONFMLFBXOJIJ-UHFFFAOYSA-N	-2	1	392.433	2.692	20	0		GFADML
Cc1nc(-c2ccc(NC[C@@H]3[C@@H](C)OC(C)(C)N3C(=O)[O-])nc2)[n-]c(=O)c1C	ZINC000830685620	604019768	/nfs/dbraw/zinc/01/97/68/604019768.db2.gz	ITAVDOJXZQZBAM-TZMCWYRMSA-N	-2	1	387.440	2.776	20	0		GFADML
Cc1cc([C@@H](C)OC(=O)c2ccc(S(=O)(=O)[N-]C(C)(C)C)o2)oc1C(=O)[O-]	ZINC000832874668	604565083	/nfs/dbraw/zinc/56/50/83/604565083.db2.gz	KKRVQLRLIMCJSU-SNVBAGLBSA-N	-2	1	399.421	2.874	20	0		GFADML
CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@@H](C(=O)[O-])c2ccccn2)c([O-])c1	ZINC000833442955	604716939	/nfs/dbraw/zinc/71/69/39/604716939.db2.gz	NAAPZDVQZWJGOF-OAHLLOKOSA-N	-2	1	387.392	2.690	20	0		GFADML
COc1ccc(S(=O)(=O)[N-]c2[nH]nc(-c3ccc(C)o3)c2C)cc1C(=O)[O-]	ZINC000433612783	604808338	/nfs/dbraw/zinc/80/83/38/604808338.db2.gz	OZDYCLXPASJQGB-UHFFFAOYSA-N	-2	1	391.405	2.794	20	0		GFADML
O=C([O-])C[C@@H]([N-]S(=O)(=O)c1cc(Br)sc1Cl)C1CC1	ZINC000776577219	604810193	/nfs/dbraw/zinc/81/01/93/604810193.db2.gz	JHRDTNPVRTYJCD-ZCFIWIBFSA-N	-2	1	388.692	2.696	20	0		GFADML
COc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(C(=O)[O-])c2C)c(C(=O)[O-])c1	ZINC000507617969	605027788	/nfs/dbraw/zinc/02/77/88/605027788.db2.gz	BOCUIGMEZHXWGV-UHFFFAOYSA-N	-3	1	399.808	2.854	20	0		GFADML
CC(C)(C)OC(=O)[C@@H]([N-]S(=O)(=O)c1ccsc1C(=O)[O-])c1ccccc1	ZINC000829538641	605049298	/nfs/dbraw/zinc/04/92/98/605049298.db2.gz	PUFVLUCRESTSGW-ZDUSSCGKSA-N	-2	1	397.474	2.808	20	0		GFADML
Cc1cc([N-]S(=O)(=O)c2cccc3c2ccnc3C(=O)[O-])cc2n[nH]cc21	ZINC000833747180	605152108	/nfs/dbraw/zinc/15/21/08/605152108.db2.gz	SKOQUOMPYJDJEI-UHFFFAOYSA-N	-2	1	382.401	2.919	20	0		GFADML
CC(C)NC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C(=O)[O-])cc1	ZINC000833501488	605167727	/nfs/dbraw/zinc/16/77/27/605167727.db2.gz	AQRPRDMTVKYJBO-UHFFFAOYSA-N	-2	1	396.852	2.977	20	0		GFADML
Cc1cc(F)c(S(=O)(=O)Nc2ccc(CCC(=O)[O-])cc2)cc1C(=O)[O-]	ZINC000833744838	605169815	/nfs/dbraw/zinc/16/98/15/605169815.db2.gz	RKRVPWPDRNFKKT-UHFFFAOYSA-N	-2	1	381.381	2.650	20	0		GFADML
Cc1cnn(-c2ccc(C(=O)[O-])cc2[N-]S(=O)(=O)c2ccc3c(c2)CCO3)c1	ZINC000833754591	605190795	/nfs/dbraw/zinc/19/07/95/605190795.db2.gz	XDLPCTCMGNANBO-UHFFFAOYSA-N	-2	1	399.428	2.615	20	0		GFADML
O=C([O-])N[C@H](C[N-]S(=O)(=O)c1c(Cl)cccc1C(F)(F)F)C1CC1	ZINC000834151318	605807036	/nfs/dbraw/zinc/80/70/36/605807036.db2.gz	SSVTXTUVWXZGPF-SNVBAGLBSA-N	-2	1	386.779	2.683	20	0		GFADML
O=C(N[N-]S(=O)(=O)c1ccc2ccccc2c1)c1ccc(Cl)cc1[O-]	ZINC000055665141	654780208	/nfs/dbraw/zinc/78/02/08/654780208.db2.gz	LNZWPYDKYTZKLT-UHFFFAOYSA-N	-2	1	376.821	2.822	20	0		GFADML
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000057116006	654800610	/nfs/dbraw/zinc/80/06/10/654800610.db2.gz	PPRYSHNXJXPNKB-UHFFFAOYSA-N	-2	1	383.809	2.919	20	0		GFADML
Cc1cc(Cl)c(C)c(S(=O)(=O)[N-][N-]C(=O)NCc2ccco2)c1Cl	ZINC000064939839	654877758	/nfs/dbraw/zinc/87/77/58/654877758.db2.gz	QSYNLOWVZQGVMH-UHFFFAOYSA-N	-2	1	392.264	2.896	20	0		GFADML
O=C([O-])c1ccccc1CC[N-]S(=O)(=O)c1sccc1Br	ZINC000070551224	654992956	/nfs/dbraw/zinc/99/29/56/654992956.db2.gz	SACNDKDUNQOLEO-UHFFFAOYSA-N	-2	1	390.280	2.730	20	0		GFADML
O=C([O-])/C=C/C[N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000312001362	655379565	/nfs/dbraw/zinc/37/95/65/655379565.db2.gz	PSTFZQFMRXUCLG-OWOJBTEDSA-N	-2	1	389.054	2.675	20	0		GFADML
Cc1sc(C(=O)[O-])cc1S(=O)(=O)[N-]c1ccc(-n2cccn2)c(F)c1	ZINC000517925529	655419239	/nfs/dbraw/zinc/41/92/39/655419239.db2.gz	UBBLYTMCENEBGA-UHFFFAOYSA-N	-2	1	381.410	2.880	20	0		GFADML
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(C)c2C(=O)[O-])ccc1Cl	ZINC000757479049	655912189	/nfs/dbraw/zinc/91/21/89/655912189.db2.gz	ZBVHFGIIYGLSAJ-UHFFFAOYSA-N	-2	1	383.809	2.934	20	0		GFADML
Cc1cc(C(N)=O)ccc1[N-]S(=O)(=O)c1cc(C)c(Cl)c(C(=O)[O-])c1	ZINC000759092234	655947135	/nfs/dbraw/zinc/94/71/35/655947135.db2.gz	YQTVAXAIEDQREQ-UHFFFAOYSA-N	-2	1	382.825	2.555	20	0		GFADML
O=C([O-])c1ccc(CC[N-]S(=O)(=O)c2c(Cl)ccnc2Cl)cc1	ZINC000776442912	656742094	/nfs/dbraw/zinc/74/20/94/656742094.db2.gz	AEERAOQGKRDQEB-UHFFFAOYSA-N	-2	1	375.233	2.608	20	0		GFADML
Cc1ccc([C@@H]([N-]S(=O)(=O)c2c(Cl)ccnc2Cl)C(=O)[O-])cc1	ZINC000776500138	656748076	/nfs/dbraw/zinc/74/80/76/656748076.db2.gz	LTEPVUSLWBQZMX-LLVKDONJSA-N	-2	1	375.233	2.801	20	0		GFADML
COc1cccc([C@@H]([N-]S(=O)(=O)c2c(Cl)ccnc2Cl)C(=O)[O-])c1	ZINC000776520174	656750491	/nfs/dbraw/zinc/75/04/91/656750491.db2.gz	JBQDXPPZVFCELB-LLVKDONJSA-N	-2	1	391.232	2.501	20	0		GFADML
CC[C@@H](C[N-]S(=O)(=O)c1cc(Cl)c(Br)cc1F)C(=O)[O-]	ZINC000788082030	657648106	/nfs/dbraw/zinc/64/81/06/657648106.db2.gz	CUSINBLBUUFRKT-LURJTMIESA-N	-2	1	388.642	2.631	20	0		GFADML
C[C@@H](CC(F)(F)F)[N-]S(=O)(=O)c1sc(C(=O)[O-])cc1Br	ZINC000871942701	662744706	/nfs/dbraw/zinc/74/47/06/662744706.db2.gz	XYKHPMRZXVYAMR-BYPYZUCNSA-N	-2	1	396.206	2.828	20	0		GFADML