smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)C[C@@H](Nc1nc2cc(Br)ccc2o1)C(=O)[O-]	ZINC000705873928	954941513	/nfs/dbraw/zinc/94/15/13/954941513.db2.gz	FVNVVOQOHRGZDK-SNVBAGLBSA-N	-1	0	327.178	3.502	10	0		EHAERM
O=C([O-])c1ccccc1C(=O)Nc1cccc(Br)c1F	ZINC000689345816	976251401	/nfs/dbraw/zinc/25/14/01/976251401.db2.gz	NXEQMAIAEFTSMB-UHFFFAOYSA-N	-1	0	338.132	3.539	10	0		EHAERM
C[C@H](c1ccc(C(=O)[O-])o1)N1Cc2ccc(Br)cc2C1	ZINC000707903884	977404309	/nfs/dbraw/zinc/40/43/09/977404309.db2.gz	CSBBFPMETACSFI-SECBINFHSA-N	-1	0	336.185	3.817	10	0		EHAERM
CC1(C)CCC[C@H](COc2ccc(C(=O)[O-])cc2Br)O1	ZINC000714320529	977667422	/nfs/dbraw/zinc/66/74/22/977667422.db2.gz	KVRWCZVXDUIXAZ-LLVKDONJSA-N	-1	0	343.217	3.874	10	0		EHAERM
CC[C@@H](c1n[n-]c(=NC(=O)N2C[C@H]3CCC[C@H]32)s1)c1ccccc1	ZINC000329943902	1024261635	/nfs/dbraw/zinc/26/16/35/1024261635.db2.gz	WMPLBAJQFHMOIQ-RBSFLKMASA-N	-1	0	342.468	3.518	10	0		EHAERM
COc1ccc([C@H]2C[C@@H](C)N(C(=O)c3ccc(F)cc3[O-])C2)cc1	ZINC000123876785	1038092087	/nfs/dbraw/zinc/09/20/87/1038092087.db2.gz	FUYJVWMDRUAEIG-OCCSQVGLSA-N	-1	0	329.371	3.558	10	0		EHAERM
COc1ccc2ccc(Oc3ccc(O[C@@H](C)C(=O)[O-])cc3)nc2c1	ZINC000013972205	201923203	/nfs/dbraw/zinc/92/32/03/201923203.db2.gz	KCYKVBTUCABITM-LBPRGKRZSA-N	-1	0	339.347	3.888	10	0		EHAERM
Cc1ccc(-c2csc3nc(C)n(CCC(=O)[O-])c(=O)c23)c(C)c1	ZINC000019954616	202027813	/nfs/dbraw/zinc/02/78/13/202027813.db2.gz	GTCMFLLSXRRADC-UHFFFAOYSA-N	-1	0	342.420	3.525	10	0		EHAERM
Cc1sc2nc(C)n(CCC(=O)[O-])c(=O)c2c1-c1ccc(C)cc1	ZINC000019954639	202028328	/nfs/dbraw/zinc/02/83/28/202028328.db2.gz	CHVRFDRRCKNONU-UHFFFAOYSA-N	-1	0	342.420	3.525	10	0		EHAERM
C[C@@H]1CCc2c(sc(NC(=O)Cc3ccc(F)cc3)c2C(=O)[O-])C1	ZINC000020333689	202039587	/nfs/dbraw/zinc/03/95/87/202039587.db2.gz	STBHLCVHZMHTRA-SNVBAGLBSA-N	-1	0	347.411	3.891	10	0		EHAERM
Cc1sc2ncnc(N3CCC[C@@H]3C(=O)[O-])c2c1-c1ccccc1	ZINC000020317994	202037664	/nfs/dbraw/zinc/03/76/64/202037664.db2.gz	NWCFRJCMVLMASF-CYBMUJFWSA-N	-1	0	339.420	3.720	10	0		EHAERM
CC(C)c1cc(OCC(=O)[O-])nc(Nc2ccc(F)c(Cl)c2)n1	ZINC000073703296	202371660	/nfs/dbraw/zinc/37/16/60/202371660.db2.gz	GQCMFXMARJWDDT-UHFFFAOYSA-N	-1	0	339.754	3.600	10	0		EHAERM
CCc1nc(-c2cccc(Cl)c2)nc(-n2ccc(C(=O)[O-])n2)c1C	ZINC000073681460	202370503	/nfs/dbraw/zinc/37/05/03/202370503.db2.gz	YUNZKATUKNEUAM-UHFFFAOYSA-N	-1	0	342.786	3.552	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1N(CC(F)(F)F)C1CC1	ZINC000042770803	202502509	/nfs/dbraw/zinc/50/25/09/202502509.db2.gz	RYCFIXVNQAQIAU-UHFFFAOYSA-N	-1	0	338.123	3.678	10	0		EHAERM
CC(C)Oc1ccc(N2CCN(c3cccc(C(=O)[O-])c3)C2=O)cc1	ZINC000090372268	201370351	/nfs/dbraw/zinc/37/03/51/201370351.db2.gz	OOEWABOIBYBKFM-UHFFFAOYSA-N	-1	0	340.379	3.619	10	0		EHAERM
CN(Cc1csc(Br)c1)c1c(F)cccc1C(=O)[O-]	ZINC000054204445	202667884	/nfs/dbraw/zinc/66/78/84/202667884.db2.gz	YKDGOLCAHOXOCW-UHFFFAOYSA-N	-1	0	344.205	3.984	10	0		EHAERM
O=C([O-])c1cn(-c2cc(-c3ccccc3)nc(-c3ccccc3)n2)cn1	ZINC000070452463	203076674	/nfs/dbraw/zinc/07/66/74/203076674.db2.gz	YMQNEYRGRNKXDX-UHFFFAOYSA-N	-1	0	342.358	3.695	10	0		EHAERM
O=C([O-])c1nnn(Cc2ccccc2Cl)c1-c1cc(F)cc(F)c1	ZINC000070457179	203077470	/nfs/dbraw/zinc/07/74/70/203077470.db2.gz	HMTAZDRURIRYFZ-UHFFFAOYSA-N	-1	0	349.724	3.623	10	0		EHAERM
Cc1ccc(Cn2cc(C(=O)[O-])c(=O)c3cc(F)c(F)cc32)c(C)c1	ZINC000070460715	203078773	/nfs/dbraw/zinc/07/87/73/203078773.db2.gz	HFEAXPXNBZXOMK-UHFFFAOYSA-N	-1	0	343.329	3.643	10	0		EHAERM
O=C([O-])[C@@H]1Cc2ccc(C(F)F)cc2N1C(=O)OCc1ccccc1	ZINC000584881876	563878487	/nfs/dbraw/zinc/87/84/87/563878487.db2.gz	GIXYRPGPBBVEAO-HNNXBMFYSA-N	-1	0	347.317	3.777	10	0		EHAERM
O=C([O-])[C@H]1Cc2ccc(C(F)F)cc2N1C(=O)OCc1ccccc1	ZINC000584881882	563878581	/nfs/dbraw/zinc/87/85/81/563878581.db2.gz	GIXYRPGPBBVEAO-OAHLLOKOSA-N	-1	0	347.317	3.777	10	0		EHAERM
O=C([O-])c1ccc(-c2csc3ncnc(Br)c23)s1	ZINC000584882328	563880775	/nfs/dbraw/zinc/88/07/75/563880775.db2.gz	BHDYKPCXROCYDX-UHFFFAOYSA-N	-1	0	341.211	3.881	10	0		EHAERM
CC(C)C1CCC(CNC(=O)OCc2ccccc2)(C(=O)[O-])CC1	ZINC000725245871	563976088	/nfs/dbraw/zinc/97/60/88/563976088.db2.gz	YMUZLWMRQYHZMX-UHFFFAOYSA-N	-1	0	333.428	3.830	10	0		EHAERM
C[C@@H]1CCCC[C@@H]1C[C@@H](CNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000725246870	563976172	/nfs/dbraw/zinc/97/61/72/563976172.db2.gz	ZLQFDVMJXGSMOV-OIISXLGYSA-N	-1	0	333.428	3.830	10	0		EHAERM
Cc1cc(C(F)(F)Br)nc(C(F)(F)F)c1C(=O)[O-]	ZINC000675082191	564114116	/nfs/dbraw/zinc/11/41/16/564114116.db2.gz	WILVPGVVEGOGOU-UHFFFAOYSA-N	-1	0	334.038	3.551	10	0		EHAERM
O=C([O-])c1ccc(Br)c(NC(=O)C23CCC(CC2)C3)c1	ZINC000710852075	969050927	/nfs/dbraw/zinc/05/09/27/969050927.db2.gz	XCJOERHKRITTDH-UHFFFAOYSA-N	-1	0	338.201	3.666	10	0		EHAERM
O=C([O-])c1ccc(C(=O)Nc2cccc(Br)c2F)cc1	ZINC000689367810	976251211	/nfs/dbraw/zinc/25/12/11/976251211.db2.gz	BQGHFMYJFYFDIX-UHFFFAOYSA-N	-1	0	338.132	3.539	10	0		EHAERM
O=C([O-])c1ccc(CNCc2ccc(Cl)o2)c(Br)c1	ZINC000698142906	976879890	/nfs/dbraw/zinc/87/98/90/976879890.db2.gz	VJAJMCQYRGILHA-UHFFFAOYSA-N	-1	0	344.592	3.684	10	0		EHAERM
C[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(Br)cc1C(=O)[O-]	ZINC000714402260	977671486	/nfs/dbraw/zinc/67/14/86/977671486.db2.gz	SOBZNDHYOCYILC-ONGXEEELSA-N	-1	0	340.217	3.912	10	0		EHAERM
O=C([O-])c1ccc(SCc2sncc2Br)cc1	ZINC000719891786	978016124	/nfs/dbraw/zinc/01/61/24/978016124.db2.gz	JKDLPTZPXKALPK-UHFFFAOYSA-N	-1	0	330.228	3.896	10	0		EHAERM
CC(C)[C@H](C)CC(=O)N[C@@H](CC(=O)[O-])c1ccc(Cl)c(F)c1	ZINC000236631859	1024053380	/nfs/dbraw/zinc/05/33/80/1024053380.db2.gz	MSSXTTXIULXWLP-YGRLFVJLSA-N	-1	0	329.799	3.793	10	0		EHAERM
CO[C@H](C)c1cccc([N-]S(=O)(=O)c2cc(F)ccc2Cl)c1	ZINC000103059497	1026044115	/nfs/dbraw/zinc/04/41/15/1026044115.db2.gz	ZWSSAXRLOVTZKX-SNVBAGLBSA-N	-1	0	343.807	3.987	10	0		EHAERM
CCN(Cc1c(F)cccc1F)C(=O)c1c([O-])cc(F)cc1F	ZINC000101678393	1026487084	/nfs/dbraw/zinc/48/70/84/1026487084.db2.gz	KGIIQSAVTQSTGI-UHFFFAOYSA-N	-1	0	327.277	3.611	10	0		EHAERM
CC(C)c1ccc(-n2cc([O-])c(C(=O)N3CC[C@H]4CCC[C@H]43)n2)cc1	ZINC000330251116	1042555522	/nfs/dbraw/zinc/55/55/22/1042555522.db2.gz	NGLACAQLWJHLIH-NVXWUHKLSA-N	-1	0	339.439	3.716	10	0		EHAERM
O=C([O-])c1nn(-c2ccc(Br)cc2)c2c1CCCCC2	ZINC000022142837	212279547	/nfs/dbraw/zinc/27/95/47/212279547.db2.gz	QLXSFVZKVPQKES-UHFFFAOYSA-N	-1	0	335.201	3.602	10	0		EHAERM
CCCC(=O)Nc1ccc(Cc2nc3cc(C(=O)[O-])ccc3[nH]2)cc1	ZINC000020980702	202059797	/nfs/dbraw/zinc/05/97/97/202059797.db2.gz	INYXTIYHQAUUFO-UHFFFAOYSA-N	-1	0	337.379	3.591	10	0		EHAERM
CCc1ccccc1NC(=O)c1c[n-]c2cc(F)cc(F)c2c1=O	ZINC000032608084	202229360	/nfs/dbraw/zinc/22/93/60/202229360.db2.gz	ICXPEPONVLIBNM-UHFFFAOYSA-N	-1	0	328.318	3.621	10	0		EHAERM
O=c1nc[n-]c2cc(-c3ccc(F)cc3Br)sc21	ZINC000037116905	202335183	/nfs/dbraw/zinc/33/51/83/202335183.db2.gz	XWJNPCHECQAORW-UHFFFAOYSA-N	-1	0	325.162	3.553	10	0		EHAERM
CCCc1nn(-c2ccc(Br)cc2)c(Cl)c1C(=O)[O-]	ZINC000037326952	202338789	/nfs/dbraw/zinc/33/87/89/202338789.db2.gz	REEPQPIXLPTYJI-UHFFFAOYSA-N	-1	0	343.608	3.939	10	0		EHAERM
O=C([O-])CCC(=O)Nc1c(Cl)cc(Br)cc1Cl	ZINC000037792698	202365739	/nfs/dbraw/zinc/36/57/39/202365739.db2.gz	OIGCWNKSCHPKNJ-UHFFFAOYSA-N	-1	0	340.988	3.559	10	0		EHAERM
Cc1ccc(Nc2nc(OCC(=O)[O-])cc(-c3ccccc3)n2)cc1	ZINC000073696982	202371833	/nfs/dbraw/zinc/37/18/33/202371833.db2.gz	SFFGBZOJRCNCIY-UHFFFAOYSA-N	-1	0	335.363	3.659	10	0		EHAERM
Cc1nc(Nc2cccc(Cl)c2Cl)nc(OCC(=O)[O-])c1C	ZINC000073702535	202371925	/nfs/dbraw/zinc/37/19/25/202371925.db2.gz	OSISREFZEHIZNM-UHFFFAOYSA-N	-1	0	342.182	3.607	10	0		EHAERM
Cc1ccccc1Nc1nc(OCC(=O)[O-])cc(-c2ccccc2)n1	ZINC000073696871	202371938	/nfs/dbraw/zinc/37/19/38/202371938.db2.gz	FLPXKXHAICNBEL-UHFFFAOYSA-N	-1	0	335.363	3.659	10	0		EHAERM
O=C([O-])c1cccc(Br)c1NC(=O)c1ccc(Cl)o1	ZINC000062826407	202802992	/nfs/dbraw/zinc/80/29/92/202802992.db2.gz	QXUKOJRAFYRGNU-UHFFFAOYSA-N	-1	0	344.548	3.646	10	0		EHAERM
CC(C)Oc1ccc(Cn2c(=O)c3ccccc3[n-]c2=S)cc1	ZINC000100090641	203052508	/nfs/dbraw/zinc/05/25/08/203052508.db2.gz	APKUAMXIBQZXIS-UHFFFAOYSA-N	-1	0	326.421	3.521	10	0		EHAERM
O=C([O-])c1ccc(C[S@](=O)c2ccc(Br)cc2)s1	ZINC000103918662	204089799	/nfs/dbraw/zinc/08/97/99/204089799.db2.gz	APNUMRBHQWHVCB-GOSISDBHSA-N	-1	0	345.239	3.517	10	0		EHAERM
CCCCc1c(C(=O)[O-])c(C)nc(C)c1C(=O)Nc1ccccc1	ZINC000196207963	535077139	/nfs/dbraw/zinc/07/71/39/535077139.db2.gz	QFSZJAFPNUMSRQ-UHFFFAOYSA-N	-1	0	326.396	3.992	10	0		EHAERM
Cc1c(C)c(C(F)(F)Br)nc(C(F)F)c1C(=O)[O-]	ZINC000675081816	564114037	/nfs/dbraw/zinc/11/40/37/564114037.db2.gz	NOAIYWYNGXZIGU-UHFFFAOYSA-N	-1	0	330.075	3.778	10	0		EHAERM
C[C@H]1CC[C@H](C)N1C(=O)Nc1cc(C(=O)[O-])ccc1Br	ZINC000707000539	954962227	/nfs/dbraw/zinc/96/22/27/954962227.db2.gz	AINZCZWWQJLRLN-IUCAKERBSA-N	-1	0	341.205	3.552	10	0		EHAERM
O=C([O-])CN(Cc1csc(-c2ccsc2)n1)Cc1ccccc1	ZINC000692409587	976450018	/nfs/dbraw/zinc/45/00/18/976450018.db2.gz	QXUTZZMATLFXCY-UHFFFAOYSA-N	-1	0	344.461	3.958	10	0		EHAERM
CCCc1nsc(Oc2cc(Br)cc(C(=O)[O-])c2)n1	ZINC000700730267	976967142	/nfs/dbraw/zinc/96/71/42/976967142.db2.gz	KPIJAKVEPVMIGT-UHFFFAOYSA-N	-1	0	343.202	3.744	10	0		EHAERM
CN(C(=O)OC(C)(C)C)c1ccc(NCc2cc(C(=O)[O-])co2)cc1	ZINC000702226073	977071000	/nfs/dbraw/zinc/07/10/00/977071000.db2.gz	AEXOHEIDCJMOKE-UHFFFAOYSA-N	-1	0	346.383	3.961	10	0		EHAERM
CCN(C(=O)Nc1ccc(Br)cc1C(=O)[O-])C1CCC1	ZINC000706902900	977367610	/nfs/dbraw/zinc/36/76/10/977367610.db2.gz	LEANPSBRRIPFAP-UHFFFAOYSA-N	-1	0	341.205	3.554	10	0		EHAERM
CCSc1n[n-]c(=NC(=O)N2CCC[C@@H]2C2CCCCC2)s1	ZINC000407953344	1016469852	/nfs/dbraw/zinc/46/98/52/1016469852.db2.gz	AZESXYLSMKXGNQ-GFCCVEGCSA-N	-1	0	340.518	3.649	10	0		EHAERM
O=C(N[C@H]1CCCC[C@@H]1n1cccn1)c1ccc2[n-]c(=S)oc2c1	ZINC000074470723	1028616051	/nfs/dbraw/zinc/61/60/51/1028616051.db2.gz	UWHFMYLGXGMZOJ-JSGCOSHPSA-N	-1	0	342.424	3.601	10	0		EHAERM
O=C(N[C@@H]1CCCC[C@H]1n1cccn1)c1ccc2[n-]c(=S)oc2c1	ZINC000074470725	1028616296	/nfs/dbraw/zinc/61/62/96/1028616296.db2.gz	UWHFMYLGXGMZOJ-TZMCWYRMSA-N	-1	0	342.424	3.601	10	0		EHAERM
CC(C)(C)SCC(=O)N[C@H](CC(=O)[O-])c1ccc(Cl)c(F)c1	ZINC000236593202	1039225656	/nfs/dbraw/zinc/22/56/56/1039225656.db2.gz	MZPFFMQGHHORRY-GFCCVEGCSA-N	-1	0	347.839	3.643	10	0		EHAERM
C[C@H]1OCCC[C@H]1C(=O)Nc1cc(Cl)cc(Br)c1[O-]	ZINC000189810183	1140365278	/nfs/dbraw/zinc/36/52/78/1140365278.db2.gz	ARDHLYPDHYNPFP-VXNVDRBHSA-N	-1	0	348.624	3.562	10	0		EHAERM
O=C([O-])Cc1csc2nc(-c3ccc(Cl)c(Cl)c3)cn12	ZINC000033418590	212936938	/nfs/dbraw/zinc/93/69/38/212936938.db2.gz	KXLOGKDPIIZGOT-UHFFFAOYSA-N	-1	0	327.192	3.997	10	0		EHAERM
COc1ccc(OCc2ccc(Br)s2)c(C(=O)[O-])c1	ZINC000037093750	202335823	/nfs/dbraw/zinc/33/58/23/202335823.db2.gz	ZDQSIRNKKFGGAM-UHFFFAOYSA-N	-1	0	343.198	3.796	10	0		EHAERM
O=C([O-])COc1cc(-c2ccccc2)nc(-c2cccc(Cl)c2)n1	ZINC000073662128	202371253	/nfs/dbraw/zinc/37/12/53/202371253.db2.gz	LHRQZGQDIOABDJ-UHFFFAOYSA-N	-1	0	340.766	3.927	10	0		EHAERM
Cc1nc(Nc2cc(Cl)cc(Cl)c2)nc(OCC(=O)[O-])c1C	ZINC000073702934	202371558	/nfs/dbraw/zinc/37/15/58/202371558.db2.gz	FCKMFHZNMYDBOK-UHFFFAOYSA-N	-1	0	342.182	3.607	10	0		EHAERM
Nc1ccc(Nc2cc(Br)ccc2F)cc1C(=O)[O-]	ZINC000037931007	202380169	/nfs/dbraw/zinc/38/01/69/202380169.db2.gz	HDQZPOLPOOHNFE-UHFFFAOYSA-N	-1	0	325.137	3.612	10	0		EHAERM
Cc1ccc(C)n1-c1nn(Cc2ccc(C(=O)[O-])cc2)c2ncccc12	ZINC000049454652	202622509	/nfs/dbraw/zinc/62/25/09/202622509.db2.gz	HAVQPMXQCFGVJG-UHFFFAOYSA-N	-1	0	346.390	3.585	10	0		EHAERM
CC(C)c1cc(N2CCC(C(=O)[O-])CC2)nc(-c2ccccc2)n1	ZINC000070452675	203076402	/nfs/dbraw/zinc/07/64/02/203076402.db2.gz	WWCMWGKPLPXCIU-UHFFFAOYSA-N	-1	0	325.412	3.568	10	0		EHAERM
CC(C)c1cc(N2CCC(C(=O)[O-])CC2)nc(-c2cccc(F)c2)n1	ZINC000070452687	203076994	/nfs/dbraw/zinc/07/69/94/203076994.db2.gz	WXKXOQPZMQZAJR-UHFFFAOYSA-N	-1	0	343.402	3.707	10	0		EHAERM
CCc1cc(N2CCC[C@@H](C(=O)[O-])C2)nc(-c2cccc(Cl)c2)n1	ZINC000070452398	203077517	/nfs/dbraw/zinc/07/75/17/203077517.db2.gz	YLSVFRALLLXAEW-CYBMUJFWSA-N	-1	0	345.830	3.660	10	0		EHAERM
CC(C)[C@@H]1CC[C@@H](C)C[C@@]1(NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000226769324	564118245	/nfs/dbraw/zinc/11/82/45/564118245.db2.gz	QDPBBDIEAIDFSL-ALKREAHSSA-N	-1	0	333.428	3.828	10	0		EHAERM
O=C([O-])c1cc(F)c2c(c1)CCCN2C(=O)OCc1ccccc1	ZINC000616568243	564177350	/nfs/dbraw/zinc/17/73/50/564177350.db2.gz	HGWIUVICMPCMRD-UHFFFAOYSA-N	-1	0	329.327	3.613	10	0		EHAERM
O=C([O-])c1ccc(OCCOCC2CCCC2)c(Br)c1	ZINC000693058300	976586056	/nfs/dbraw/zinc/58/60/56/976586056.db2.gz	OTMPFJLZMIFKQL-UHFFFAOYSA-N	-1	0	343.217	3.733	10	0		EHAERM
Cc1cc(C(=O)Nc2ccc(C)cc2Br)oc1C(=O)[O-]	ZINC000704799626	977260199	/nfs/dbraw/zinc/26/01/99/977260199.db2.gz	XOABOVPUMATUKB-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
CN(Cc1ccsc1C(=O)[O-])Cc1cscc1Br	ZINC000709866710	977471857	/nfs/dbraw/zinc/47/18/57/977471857.db2.gz	BFXALCDGLJAJTB-UHFFFAOYSA-N	-1	0	346.271	3.902	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1NC(=O)C[C@@H]1CC[C@H]2C[C@H]21	ZINC000717662682	977905425	/nfs/dbraw/zinc/90/54/25/977905425.db2.gz	VZXPFBKPNZQQBK-HOTUBEGUSA-N	-1	0	338.201	3.522	10	0		EHAERM
O=C([O-])c1cc(NC(=O)C[C@@H]2CC[C@@H]3C[C@@H]32)ccc1Br	ZINC000717658941	977905694	/nfs/dbraw/zinc/90/56/94/977905694.db2.gz	DMWMXQSERQLBQS-YWVKMMECSA-N	-1	0	338.201	3.522	10	0		EHAERM
O=C(c1cc(F)c([O-])c(Cl)c1)N1CCC[C@H](c2nccs2)C1	ZINC000184409698	1032269164	/nfs/dbraw/zinc/26/91/64/1032269164.db2.gz	QAENZZZTFDISMB-VIFPVBQESA-N	-1	0	340.807	3.661	10	0		EHAERM
CC[C@@H](c1n[n-]c(=NC(=O)N2C[C@@H]3CCC[C@H]32)s1)c1ccccc1	ZINC000329943903	1024261360	/nfs/dbraw/zinc/26/13/60/1024261360.db2.gz	WMPLBAJQFHMOIQ-RRFJBIMHSA-N	-1	0	342.468	3.518	10	0		EHAERM
CC1(C)CCCCN(C(=O)N=c2[n-]nc(-c3ccsc3)s2)C1	ZINC000408443058	1040772022	/nfs/dbraw/zinc/77/20/22/1040772022.db2.gz	NSKULAYXHFPQKY-UHFFFAOYSA-N	-1	0	336.486	3.733	10	0		EHAERM
C[C@@H]1OCCC[C@@H]1C(=O)Nc1cc(Cl)cc(Br)c1[O-]	ZINC000189810237	1140365019	/nfs/dbraw/zinc/36/50/19/1140365019.db2.gz	ARDHLYPDHYNPFP-CBAPKCEASA-N	-1	0	348.624	3.562	10	0		EHAERM
Cc1cc(OCC(=O)[O-])nc(Nc2ccc(-c3ccccc3)cc2)n1	ZINC000073698072	202371777	/nfs/dbraw/zinc/37/17/77/202371777.db2.gz	SPQOITIZSUVAES-UHFFFAOYSA-N	-1	0	335.363	3.659	10	0		EHAERM
Cc1ccc(Nc2nc(OCC(=O)[O-])cc(C(C)C)n2)c(Cl)c1	ZINC000073704427	202371900	/nfs/dbraw/zinc/37/19/00/202371900.db2.gz	CZPCNXRIVBSNOE-UHFFFAOYSA-N	-1	0	335.791	3.769	10	0		EHAERM
CSc1cccc(Nc2nc(OCC(=O)[O-])cc(C(C)(C)C)n2)c1	ZINC000073700124	202371985	/nfs/dbraw/zinc/37/19/85/202371985.db2.gz	OFYVXTZGXWCLCS-UHFFFAOYSA-N	-1	0	347.440	3.703	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1NC(=O)CC1CCCC1	ZINC000037895048	202373421	/nfs/dbraw/zinc/37/34/21/202373421.db2.gz	WZIPSQUJLPLWSI-UHFFFAOYSA-N	-1	0	326.190	3.666	10	0		EHAERM
Nc1ccc(Oc2ccc(Br)cc2F)c(C(=O)[O-])c1	ZINC000037933625	202379429	/nfs/dbraw/zinc/37/94/29/202379429.db2.gz	VQNDXQVDRFRNAJ-UHFFFAOYSA-N	-1	0	326.121	3.661	10	0		EHAERM
O=S(=O)([N-]c1cc(Cl)cc(Cl)c1)c1ccnc(Cl)c1	ZINC000038008528	202386098	/nfs/dbraw/zinc/38/60/98/202386098.db2.gz	RCLUBGVDSIYHIX-UHFFFAOYSA-N	-1	0	337.615	3.843	10	0		EHAERM
CC(C)c1cc(N2CCC[C@H](C(=O)[O-])C2)nc(-c2ccccc2F)n1	ZINC000070452337	203076895	/nfs/dbraw/zinc/07/68/95/203076895.db2.gz	DLYVJXFKDXVVHV-ZDUSSCGKSA-N	-1	0	343.402	3.707	10	0		EHAERM
O=C([O-])c1ccn(-c2cc(-c3ccccc3)nc(-c3ccccc3)n2)n1	ZINC000070452569	203076476	/nfs/dbraw/zinc/07/64/76/203076476.db2.gz	SLZSPKVROBEYCH-UHFFFAOYSA-N	-1	0	342.358	3.695	10	0		EHAERM
O=C([O-])Cn1c(-c2nc(-c3cccs3)no2)cc2ccccc21	ZINC000070458660	203076772	/nfs/dbraw/zinc/07/67/72/203076772.db2.gz	AKLJVWFHODNYCC-UHFFFAOYSA-N	-1	0	325.349	3.504	10	0		EHAERM
CCCc1cc(N2CCC[C@H](C(=O)[O-])C2)nc(-c2ccc(C)cc2)n1	ZINC000070452311	203077475	/nfs/dbraw/zinc/07/74/75/203077475.db2.gz	JHPSUEXVFBGNEK-INIZCTEOSA-N	-1	0	339.439	3.706	10	0		EHAERM
Cc1sc(NC(=O)COc2c(C)cccc2C)c(C(=O)[O-])c1C	ZINC000020332790	212119797	/nfs/dbraw/zinc/11/97/97/212119797.db2.gz	OIORNVKFHIWAKC-UHFFFAOYSA-N	-1	0	333.409	3.697	10	0		EHAERM
O=C([O-])C1(CNC(=O)OCc2ccccc2)CC2(C1)CCCCC2	ZINC000722624766	563935378	/nfs/dbraw/zinc/93/53/78/563935378.db2.gz	WIRRMRVCTYLTIL-UHFFFAOYSA-N	-1	0	331.412	3.728	10	0		EHAERM
CC1=C[C@H](C)C[C@H](C[C@H](CNC(=O)OCc2ccccc2)C(=O)[O-])C1	ZINC000725246651	563976121	/nfs/dbraw/zinc/97/61/21/563976121.db2.gz	RRPQTOJEWJMDFK-JCGIZDLHSA-N	-1	0	345.439	3.996	10	0		EHAERM
CC(C)(C)OC(=O)N[C@H](CCc1cccc2ccccc21)C(=O)[O-]	ZINC000095749291	563977692	/nfs/dbraw/zinc/97/76/92/563977692.db2.gz	NJBRIISKLYUGBL-MRXNPFEDSA-N	-1	0	329.396	3.750	10	0		EHAERM
COc1ccc2c(c1)[C@H](CC(=O)[O-])C[C@@H](C)N2C(=O)OC(C)(C)C	ZINC000725253850	563982226	/nfs/dbraw/zinc/98/22/26/563982226.db2.gz	MNUJRSOIYMIYMH-NEPJUHHUSA-N	-1	0	335.400	3.787	10	0		EHAERM
CCCCC(=O)Nc1cnc(N(C)Cc2ccccc2)c(C(=O)[O-])c1	ZINC000064978531	564098870	/nfs/dbraw/zinc/09/88/70/564098870.db2.gz	JOPDNOJNKIIQON-UHFFFAOYSA-N	-1	0	341.411	3.545	10	0		EHAERM
Cc1ccc(CCC(=O)N(CC(=O)[O-])Cc2ccccc2)cc1Cl	ZINC000692417856	976458583	/nfs/dbraw/zinc/45/85/83/976458583.db2.gz	NSGVEYFNVCSJQD-UHFFFAOYSA-N	-1	0	345.826	3.694	10	0		EHAERM
O=C([O-])c1ccc(Cl)cc1OCc1ncc(Br)s1	ZINC000713692810	977656817	/nfs/dbraw/zinc/65/68/17/977656817.db2.gz	GWXCRXZNDALOEF-UHFFFAOYSA-N	-1	0	348.605	3.836	10	0		EHAERM
CC(F)(F)CCC(=O)Nc1ccc(Br)cc1C(=O)[O-]	ZINC000714129065	977662227	/nfs/dbraw/zinc/66/22/27/977662227.db2.gz	DMSVIKQASHMBMZ-UHFFFAOYSA-N	-1	0	336.132	3.521	10	0		EHAERM
C[C@@H]1CCCC[C@@H]1C(=O)Nc1cc(Br)ccc1C(=O)[O-]	ZINC000714401945	977671594	/nfs/dbraw/zinc/67/15/94/977671594.db2.gz	PFSIMVRAJRQOMV-KOLCDFICSA-N	-1	0	340.217	3.912	10	0		EHAERM
C[C@H](NC(=O)[C@H]1CCC[C@@H](C(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000245671826	1030197680	/nfs/dbraw/zinc/19/76/80/1030197680.db2.gz	HMAIPVNCEPAHLT-WCFLWFBJSA-N	-1	0	343.345	3.774	10	0		EHAERM
O=C([O-])c1nc(Nc2cccc(Br)c2)ccc1Cl	ZINC000019965960	202028684	/nfs/dbraw/zinc/02/86/84/202028684.db2.gz	FOVFUVSJOJSWOO-UHFFFAOYSA-N	-1	0	327.565	3.939	10	0		EHAERM
CCc1ccc(-c2csc3ncnc(NCCC(=O)[O-])c23)cc1	ZINC000020312647	202037590	/nfs/dbraw/zinc/03/75/90/202037590.db2.gz	XGEJNXLCDGXVGY-UHFFFAOYSA-N	-1	0	327.409	3.807	10	0		EHAERM
Cc1ccc(-c2csc(NC(=O)[C@@H]3CCCO3)c2C(=O)[O-])cc1	ZINC000020334113	202039134	/nfs/dbraw/zinc/03/91/34/202039134.db2.gz	DIYXXXFLULADTL-ZDUSSCGKSA-N	-1	0	331.393	3.539	10	0		EHAERM
CC(C)[C@@](C)(CC(=O)Nc1ccc(Br)cc1)C(=O)[O-]	ZINC000035125753	202288443	/nfs/dbraw/zinc/28/84/43/202288443.db2.gz	DVYGHPZUYOUHKF-CQSZACIVSA-N	-1	0	328.206	3.525	10	0		EHAERM
CC[C@H](C)n1c(=O)c2cc(Cl)ccc2nc1SCCC(=O)[O-]	ZINC000073660215	202371117	/nfs/dbraw/zinc/37/11/17/202371117.db2.gz	NUJYXGVTHSASAS-VIFPVBQESA-N	-1	0	340.832	3.588	10	0		EHAERM
O=C([O-])c1ccccc1[S@](=O)Cc1ccc(Br)s1	ZINC000037922848	202377821	/nfs/dbraw/zinc/37/78/21/202377821.db2.gz	QYNAWBRKMWLUOM-SFHVURJKSA-N	-1	0	345.239	3.517	10	0		EHAERM
O=C([O-])CSc1cc(SCc2ccccc2Cl)ncn1	ZINC000073667506	202370592	/nfs/dbraw/zinc/37/05/92/202370592.db2.gz	WXMUISYALFSMHF-UHFFFAOYSA-N	-1	0	326.830	3.599	10	0		EHAERM
CCN(c1ccccc1)c1ncnc(Nc2ccc(C(=O)[O-])cc2)c1N	ZINC000040679822	202458710	/nfs/dbraw/zinc/45/87/10/202458710.db2.gz	WJONGXJVVZYOON-UHFFFAOYSA-N	-1	0	349.394	3.659	10	0		EHAERM
CC(C)c1ccc(-c2csc3ncnc(NCC(=O)[O-])c23)cc1	ZINC000058279435	202750522	/nfs/dbraw/zinc/75/05/22/202750522.db2.gz	BCQKZTKHLQVYJB-UHFFFAOYSA-N	-1	0	327.409	3.978	10	0		EHAERM
Cc1cc(N2CCCC[C@@H]2C(=O)[O-])nc(-c2ccc(Cl)cc2)n1	ZINC000070452249	203077075	/nfs/dbraw/zinc/07/70/75/203077075.db2.gz	VEUFELPYNHSAJP-CQSZACIVSA-N	-1	0	331.803	3.549	10	0		EHAERM
COc1cccc(/C=C/C(=O)Nc2sc(C)c(C)c2C(=O)[O-])c1	ZINC000020332873	212120370	/nfs/dbraw/zinc/12/03/70/212120370.db2.gz	YESWJWFFZYFPED-BQYQJAHWSA-N	-1	0	331.393	3.724	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1OCCc1cccs1	ZINC000104283323	204103358	/nfs/dbraw/zinc/10/33/58/204103358.db2.gz	PUKGALXDMJVFTO-UHFFFAOYSA-N	-1	0	327.199	3.830	10	0		EHAERM
O=C([O-])[C@H]1Cc2c(cc(F)cc2Cl)N1C(=O)OCc1ccccc1	ZINC000584882275	563880768	/nfs/dbraw/zinc/88/07/68/563880768.db2.gz	YPBCWRXJKAGFOH-OAHLLOKOSA-N	-1	0	349.745	3.632	10	0		EHAERM
CC(C)c1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C(=O)[O-])cc1	ZINC000085488145	563973849	/nfs/dbraw/zinc/97/38/49/563973849.db2.gz	JDEWSAXOVLKJBE-HZPDHXFCSA-N	-1	0	333.428	3.845	10	0		EHAERM
O=C(Cc1ccccc1)N1[N-]C(=S)SC=C1c1ccc(F)cc1	ZINC000000389436	564082592	/nfs/dbraw/zinc/08/25/92/564082592.db2.gz	ZBSVQQBKSZVLQI-UHFFFAOYSA-N	-1	0	344.436	3.732	10	0		EHAERM
CCCCN(C)c1ncc(NC(=O)c2cccc(C)c2)cc1C(=O)[O-]	ZINC000064978470	564098879	/nfs/dbraw/zinc/09/88/79/564098879.db2.gz	XZGZPUXGYGDUQD-UHFFFAOYSA-N	-1	0	341.411	3.577	10	0		EHAERM
CC1(C)CN(Cc2ccc(C(=O)[O-])cc2Br)C1(C)C	ZINC000690250856	976282863	/nfs/dbraw/zinc/28/28/63/976282863.db2.gz	HBTMHWROUQQTPO-UHFFFAOYSA-N	-1	0	326.234	3.768	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OCc2ccc(Cl)cn2)c1	ZINC000700725830	976966682	/nfs/dbraw/zinc/96/66/82/976966682.db2.gz	AAIHJJDIOAQSOH-UHFFFAOYSA-N	-1	0	342.576	3.775	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OCc2cnoc2C2CC2)c1	ZINC000700772842	976970988	/nfs/dbraw/zinc/97/09/88/976970988.db2.gz	ADHFXUGYIXLRGS-UHFFFAOYSA-N	-1	0	338.157	3.592	10	0		EHAERM
Cc1cc(C(=O)Nc2cccc(C)c2Br)oc1C(=O)[O-]	ZINC000704799150	977260627	/nfs/dbraw/zinc/26/06/27/977260627.db2.gz	WHTHBRJFVMCMMK-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
O=C([O-])c1csc(COc2ccc(Br)cc2F)c1	ZINC000711425303	977546830	/nfs/dbraw/zinc/54/68/30/977546830.db2.gz	UKESMBBPIKOFFQ-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
Cc1cc(OCc2ncc(Br)s2)c(C(=O)[O-])s1	ZINC000713676804	977656889	/nfs/dbraw/zinc/65/68/89/977656889.db2.gz	GPVHBNPQQUOFJM-UHFFFAOYSA-N	-1	0	334.216	3.553	10	0		EHAERM
Cc1cc(C(=O)[O-])oc1C(=O)Nc1ccc(Br)cc1C	ZINC000717245393	977884524	/nfs/dbraw/zinc/88/45/24/977884524.db2.gz	KGOMZDWVZDWHST-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
CCSc1n[n-]c(=NC(=O)N2CCC[C@H]2C2CCCCC2)s1	ZINC000407953346	1016471128	/nfs/dbraw/zinc/47/11/28/1016471128.db2.gz	AZESXYLSMKXGNQ-LBPRGKRZSA-N	-1	0	340.518	3.649	10	0		EHAERM
CCc1oc(C(=O)N2CC=C(c3ccc(F)cc3)CC2)cc1C(=O)[O-]	ZINC000261627298	1029462243	/nfs/dbraw/zinc/46/22/43/1029462243.db2.gz	IUDVTOBAQTWIJD-UHFFFAOYSA-N	-1	0	343.354	3.609	10	0		EHAERM
O=C([O-])[C@@H]1CC[C@H]1C(=O)N1CCCCC[C@@H]1/C=C/c1cccs1	ZINC000261963164	1029540492	/nfs/dbraw/zinc/54/04/92/1029540492.db2.gz	AUPRNQINXMYEMZ-VVTOVXDBSA-N	-1	0	333.453	3.643	10	0		EHAERM
O=C([O-])/C=C/c1cc(Br)ccc1OCc1cscn1	ZINC000020284569	202036913	/nfs/dbraw/zinc/03/69/13/202036913.db2.gz	CGNXDYXPCDKBEL-DAFODLJHSA-N	-1	0	340.198	3.582	10	0		EHAERM
CC(C)(C)[C@@H]1CCc2c(sc3ncnc(NCCC(=O)[O-])c32)C1	ZINC000020314420	202038035	/nfs/dbraw/zinc/03/80/35/202038035.db2.gz	BCWCWRHINCSVHX-SNVBAGLBSA-N	-1	0	333.457	3.729	10	0		EHAERM
Cc1ccc(-c2csc3ncnc(N(C)CCC(=O)[O-])c23)cc1C	ZINC000020317913	202038120	/nfs/dbraw/zinc/03/81/20/202038120.db2.gz	ZYFVZUALDMSGGI-UHFFFAOYSA-N	-1	0	341.436	3.886	10	0		EHAERM
CCc1cc2c(nc(C)nc2Nc2ccc(O)c(C(=O)[O-])c2)s1	ZINC000020326687	202038332	/nfs/dbraw/zinc/03/83/32/202038332.db2.gz	DOUVYFAQAFCZSX-UHFFFAOYSA-N	-1	0	329.381	3.710	10	0		EHAERM
C[C@@H]1CCc2c(sc(NC(=O)c3ccc(F)cc3)c2C(=O)[O-])C1	ZINC000020333618	202038795	/nfs/dbraw/zinc/03/87/95/202038795.db2.gz	QZIHXWALFATFCV-SECBINFHSA-N	-1	0	333.384	3.963	10	0		EHAERM
C[C@H]1CCc2c(sc(NC(=O)c3ccccc3F)c2C(=O)[O-])C1	ZINC000020333611	202039539	/nfs/dbraw/zinc/03/95/39/202039539.db2.gz	JTXIFICUYCZHBU-VIFPVBQESA-N	-1	0	333.384	3.963	10	0		EHAERM
Cc1cc(NC(=O)c2ccc(Br)cc2)sc1C(=O)[O-]	ZINC000022143619	202080149	/nfs/dbraw/zinc/08/01/49/202080149.db2.gz	VXNHQWOIKPEDMV-UHFFFAOYSA-N	-1	0	340.198	3.770	10	0		EHAERM
CC(C)[C@@](C)(CC(=O)Nc1cccc(Br)c1)C(=O)[O-]	ZINC000035125758	202287675	/nfs/dbraw/zinc/28/76/75/202287675.db2.gz	BXOIFAIAJOCYLQ-CQSZACIVSA-N	-1	0	328.206	3.525	10	0		EHAERM
Cc1ccccc1NC(=O)CS/C(=C/c1ccc(F)cc1)C(=O)[O-]	ZINC000037117761	202335195	/nfs/dbraw/zinc/33/51/95/202335195.db2.gz	WLNMRXKTKJMEAW-MHWRWJLKSA-N	-1	0	345.395	3.932	10	0		EHAERM
CC[C@H](C(=O)[O-])n1cnc2sc3c(c2c1=O)CC[C@H](C(C)(C)C)C3	ZINC000005675784	201659946	/nfs/dbraw/zinc/65/99/46/201659946.db2.gz	XLNNASQHUQGUCG-CMPLNLGQSA-N	-1	0	348.468	3.645	10	0		EHAERM
COC(=O)c1cc(-c2cnc(Cl)cc2C(=O)[O-])ccc1Cl	ZINC000065349048	202836405	/nfs/dbraw/zinc/83/64/05/202836405.db2.gz	DOYCVZVNSQCGMQ-UHFFFAOYSA-N	-1	0	326.135	3.540	10	0		EHAERM
CCCc1cc(N2CCCC[C@H]2C(=O)[O-])nc(-c2ccccc2)n1	ZINC000070452132	203074982	/nfs/dbraw/zinc/07/49/82/203074982.db2.gz	HXKINIOZCYAPGV-INIZCTEOSA-N	-1	0	325.412	3.540	10	0		EHAERM
CC(C)c1cc(N2CCC(C(=O)[O-])CC2)nc(-c2ccccc2F)n1	ZINC000070452694	203076821	/nfs/dbraw/zinc/07/68/21/203076821.db2.gz	NJSJXGVNDGYLRQ-UHFFFAOYSA-N	-1	0	343.402	3.707	10	0		EHAERM
CCCc1cc(-n2ccc(C(=O)[O-])n2)nc(-c2ccc(Cl)cc2)n1	ZINC000070452655	203077111	/nfs/dbraw/zinc/07/71/11/203077111.db2.gz	LSZVJPKSDXIOCK-UHFFFAOYSA-N	-1	0	342.786	3.633	10	0		EHAERM
Cc1cc(N2CCCC[C@H]2C(=O)[O-])nc(-c2ccc(Cl)cc2)n1	ZINC000070452250	203077116	/nfs/dbraw/zinc/07/71/16/203077116.db2.gz	VEUFELPYNHSAJP-AWEZNQCLSA-N	-1	0	331.803	3.549	10	0		EHAERM
Cc1ccc(-c2c(C(=O)[O-])nnn2-c2ccc(C(F)(F)F)cc2)cc1	ZINC000070456857	203077465	/nfs/dbraw/zinc/07/74/65/203077465.db2.gz	BGCLNETUPKBZEL-UHFFFAOYSA-N	-1	0	347.296	3.960	10	0		EHAERM
O=C([O-])c1cn(Cc2c(F)cccc2Cl)c2ccccc2c1=O	ZINC000070460662	203078675	/nfs/dbraw/zinc/07/86/75/203078675.db2.gz	LVCMJDBFEOVZNP-UHFFFAOYSA-N	-1	0	331.730	3.541	10	0		EHAERM
O=C([O-])c1ccc(F)cc1NC(=O)c1ccccc1Br	ZINC000013303088	207379137	/nfs/dbraw/zinc/37/91/37/207379137.db2.gz	IDMLZZZPAOVREK-UHFFFAOYSA-N	-1	0	338.132	3.539	10	0		EHAERM
CCN(c1cccc(C)c1)c1nc(OCC(=O)[O-])cc(C(C)(C)C)n1	ZINC000073698417	521495386	/nfs/dbraw/zinc/49/53/86/521495386.db2.gz	ZNGBTVPTPQRAOR-UHFFFAOYSA-N	-1	0	343.427	3.704	10	0		EHAERM
O=C([O-])c1cc(/C=C/c2ccnn2C2CCOCC2)nc2ccccc21	ZINC000685939110	564036332	/nfs/dbraw/zinc/03/63/32/564036332.db2.gz	HVZSRSQJJUDBFY-AATRIKPKSA-N	-1	0	349.390	3.651	10	0		EHAERM
Cc1c2ccccc2oc1-c1nc(=O)c2c(C)c(C(=O)[O-])sc2[nH]1	ZINC000012821508	564074600	/nfs/dbraw/zinc/07/46/00/564074600.db2.gz	KMSATEWCIBPYBD-UHFFFAOYSA-N	-1	0	340.360	3.713	10	0		EHAERM
CCN(CC)c1ncc(NC(=O)c2ccc(Cl)cc2)cc1C(=O)[O-]	ZINC000064978744	564098860	/nfs/dbraw/zinc/09/88/60/564098860.db2.gz	ZTIUJFXTRPZZPL-UHFFFAOYSA-N	-1	0	347.802	3.532	10	0		EHAERM
Cc1cc(Br)c(C(=O)[O-])cc1NC(=O)[C@@H](C)C1CCC1	ZINC000692716993	976538350	/nfs/dbraw/zinc/53/83/50/976538350.db2.gz	BSTBUJGNVGZCET-VIFPVBQESA-N	-1	0	340.217	3.830	10	0		EHAERM
Cc1c(F)c(Br)ccc1NCc1ncc(C(=O)[O-])s1	ZINC000693974284	976660609	/nfs/dbraw/zinc/66/06/09/976660609.db2.gz	QZMRVWHDTOGNHF-UHFFFAOYSA-N	-1	0	345.193	3.663	10	0		EHAERM
O=C([O-])c1csc(CN2CCc3c2cccc3Br)c1	ZINC000713316322	977633113	/nfs/dbraw/zinc/63/31/13/977633113.db2.gz	PRKZCWZZRZSIQK-UHFFFAOYSA-N	-1	0	338.226	3.772	10	0		EHAERM
C[C@H](c1ccc(C(=O)[O-])o1)N1CCc2ccc(Br)cc21	ZINC000713325860	977633125	/nfs/dbraw/zinc/63/31/25/977633125.db2.gz	WHZCZGINJXSHQK-SECBINFHSA-N	-1	0	336.185	3.864	10	0		EHAERM
O=C([O-])c1cc(Br)cc(Oc2cc(C(F)F)ncn2)c1	ZINC000724632764	978232687	/nfs/dbraw/zinc/23/26/87/978232687.db2.gz	CHHGNOSIFNYMKT-UHFFFAOYSA-N	-1	0	345.099	3.667	10	0		EHAERM
O=C(c1nn(-c2ccccc2F)cc1[O-])N1CCC[C@@H]2CCCC[C@H]21	ZINC000408006089	1016863102	/nfs/dbraw/zinc/86/31/02/1016863102.db2.gz	XTZFNDJILRGFOW-DZGCQCFKSA-N	-1	0	343.402	3.512	10	0		EHAERM
Cc1cc(C(=O)N2C[C@H](C(=O)[O-])C[C@@H](c3ccccc3)C2)sc1C	ZINC000180313540	1031876503	/nfs/dbraw/zinc/87/65/03/1031876503.db2.gz	NGIUOTORIGWYRU-HZPDHXFCSA-N	-1	0	343.448	3.695	10	0		EHAERM
CO[C@H](C)c1cccc(NS(=O)(=O)c2ccc3c(c2)C[C@@H](C)O3)c1	ZINC000106007641	1037293780	/nfs/dbraw/zinc/29/37/80/1037293780.db2.gz	QTNNMTXEVQUGOY-CHWSQXEVSA-N	-1	0	347.436	3.518	10	0		EHAERM
CC(C)c1ccc(-n2cc([O-])c(C(=O)N3CC[C@H]4CCC[C@@H]43)n2)cc1	ZINC000330251118	1042555476	/nfs/dbraw/zinc/55/54/76/1042555476.db2.gz	NGLACAQLWJHLIH-WBVHZDCISA-N	-1	0	339.439	3.716	10	0		EHAERM
CC[C@@H](Sc1nc(=O)c2c(-c3ccccc3)csc2[nH]1)C(=O)[O-]	ZINC000019955084	202027391	/nfs/dbraw/zinc/02/73/91/202027391.db2.gz	OHLMIGQXWVLIOK-LLVKDONJSA-N	-1	0	346.433	3.607	10	0		EHAERM
O=C([O-])c1ccn(-c2c(Cl)cc(Br)cc2Cl)n1	ZINC000020505998	202046149	/nfs/dbraw/zinc/04/61/49/202046149.db2.gz	RLLXNUIOGATHEH-UHFFFAOYSA-N	-1	0	335.972	3.640	10	0		EHAERM
O=C([O-])c1ccccc1OCc1ccc(Br)cc1F	ZINC000035082713	202286312	/nfs/dbraw/zinc/28/63/12/202286312.db2.gz	IRVNMOJXCFMJAV-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
CCCCc1ccc(Nc2nc3c(c(OCC(=O)[O-])n2)CCC3)cc1	ZINC000073697864	202372245	/nfs/dbraw/zinc/37/22/45/202372245.db2.gz	XUUVSJFXOCREQU-UHFFFAOYSA-N	-1	0	341.411	3.515	10	0		EHAERM
O=C([O-])CSc1cc(-c2cccnc2)nc(-c2ccc(F)cc2)n1	ZINC000073695740	202372371	/nfs/dbraw/zinc/37/23/71/202372371.db2.gz	YACNWHIRQBHJLE-UHFFFAOYSA-N	-1	0	341.367	3.521	10	0		EHAERM
Nc1cc(C(=O)[O-])ccc1Oc1ccc(Br)cc1F	ZINC000037933626	202379839	/nfs/dbraw/zinc/37/98/39/202379839.db2.gz	HKRXPFXTRPPINX-UHFFFAOYSA-N	-1	0	326.121	3.661	10	0		EHAERM
O=C([O-])[C@@H](NCc1cccs1)c1cc(Br)ccc1F	ZINC000037966568	202381519	/nfs/dbraw/zinc/38/15/19/202381519.db2.gz	RRCICNBXUYFULQ-LBPRGKRZSA-N	-1	0	344.205	3.565	10	0		EHAERM
Cc1ccccc1CSc1nc2ccncc2n1[C@H](C)C(=O)[O-]	ZINC000049454618	202622867	/nfs/dbraw/zinc/62/28/67/202622867.db2.gz	WWOGEHOKAKGJQO-GFCCVEGCSA-N	-1	0	327.409	3.678	10	0		EHAERM
O=c1c2ccccc2[n-]c(=S)n1Cc1ccc(C(F)(F)F)cc1	ZINC000100090553	203052645	/nfs/dbraw/zinc/05/26/45/203052645.db2.gz	TVLQMYSQEZABDO-UHFFFAOYSA-N	-1	0	336.338	3.752	10	0		EHAERM
CCc1c(C)nc(-c2ccc(C)cc2)nc1N1CCC[C@H](C(=O)[O-])C1	ZINC000070452317	203076568	/nfs/dbraw/zinc/07/65/68/203076568.db2.gz	MPEFYTHKGKPTGW-INIZCTEOSA-N	-1	0	339.439	3.624	10	0		EHAERM
O=C([O-])c1c(O)c2cccc(C(F)(F)F)c2nc1C(F)(F)F	ZINC000075895069	203326845	/nfs/dbraw/zinc/32/68/45/203326845.db2.gz	PZHCUXLWGGIIJQ-UHFFFAOYSA-N	-1	0	325.164	3.676	10	0		EHAERM
CCN(CC)c1nc2nc(-c3ccccc3)cc(C(=O)[O-])c2s1	ZINC000217015717	535688515	/nfs/dbraw/zinc/68/85/15/535688515.db2.gz	IMEADTMSQXBZJY-UHFFFAOYSA-N	-1	0	327.409	3.903	10	0		EHAERM
C[C@@H]1CCCC[C@H]1C[C@H](CNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000725246869	563976128	/nfs/dbraw/zinc/97/61/28/563976128.db2.gz	ZLQFDVMJXGSMOV-HYVNUMGLSA-N	-1	0	333.428	3.830	10	0		EHAERM
CCCN(CCC)c1ncc(NC(=O)c2cccs2)cc1C(=O)[O-]	ZINC000064978540	564098855	/nfs/dbraw/zinc/09/88/55/564098855.db2.gz	OWJLEFHLUOEEFF-UHFFFAOYSA-N	-1	0	347.440	3.720	10	0		EHAERM
O=C([O-])c1ccc(Br)c(NC(=O)C2CC3(CCC3)C2)c1	ZINC000691948893	954689658	/nfs/dbraw/zinc/68/96/58/954689658.db2.gz	KQDAWYGBDSAJAJ-UHFFFAOYSA-N	-1	0	338.201	3.666	10	0		EHAERM
O=C([O-])CCN(Cc1ccccc1)C(=O)C(C1CCC1)C1CCC1	ZINC000692436950	976476575	/nfs/dbraw/zinc/47/65/75/976476575.db2.gz	OJHIPPZMRFUAEX-UHFFFAOYSA-N	-1	0	329.440	3.706	10	0		EHAERM
O=C(N[C@H]1CCCC[C@H]1n1cccn1)c1ccc2[n-]c(=S)oc2c1	ZINC000074470697	1028615921	/nfs/dbraw/zinc/61/59/21/1028615921.db2.gz	UWHFMYLGXGMZOJ-GXTWGEPZSA-N	-1	0	342.424	3.601	10	0		EHAERM
Cc1nc([C@H]2CCCN(C(=O)c3c([O-])cccc3F)C2)sc1C	ZINC000408407194	1030454849	/nfs/dbraw/zinc/45/48/49/1030454849.db2.gz	KISZIJKSJLNWQU-LBPRGKRZSA-N	-1	0	334.416	3.624	10	0		EHAERM
C[C@H]1CN(C(=O)c2c([O-])c(Cl)cc(Cl)c2Cl)CCCO1	ZINC000171209767	1030745531	/nfs/dbraw/zinc/74/55/31/1030745531.db2.gz	LWMPZRQOSDNZLE-ZETCQYMHSA-N	-1	0	338.618	3.603	10	0		EHAERM
Cc1nc([C@@H]2CCCN2C(=O)c2cc(F)c([O-])c(Cl)c2)cs1	ZINC000192568286	1140538411	/nfs/dbraw/zinc/53/84/11/1140538411.db2.gz	RUUHBGSNFRDPKL-ZDUSSCGKSA-N	-1	0	340.807	3.927	10	0		EHAERM
O=C([O-])c1cc(-c2cccc(O)c2)nc2n[nH]c(-c3ccccc3)c21	ZINC000006749023	201694525	/nfs/dbraw/zinc/69/45/25/201694525.db2.gz	SCMJYYJPPFVRGO-UHFFFAOYSA-N	-1	0	331.331	3.696	10	0		EHAERM
Cc1ccccc1NC(=O)CS/C(=C/c1ccccc1)C(=O)[O-]	ZINC000015055495	201949018	/nfs/dbraw/zinc/94/90/18/201949018.db2.gz	DKOPJYXVVXBMQX-LFIBNONCSA-N	-1	0	327.405	3.792	10	0		EHAERM
O=C([O-])[C@H]1c2ccccc2C(=O)N(Cc2ccccc2)[C@@H]1c1ccco1	ZINC000033413921	202260801	/nfs/dbraw/zinc/26/08/01/202260801.db2.gz	LGUXHAPLAXZOJL-RBUKOAKNSA-N	-1	0	347.370	3.845	10	0		EHAERM
O=C([O-])c1c(O)c(Cc2c[nH]c3ccccc23)nc2c(F)cccc21	ZINC000035087104	213008051	/nfs/dbraw/zinc/00/80/51/213008051.db2.gz	UXTGRGZIHAMALQ-UHFFFAOYSA-N	-1	0	336.322	3.850	10	0		EHAERM
Cc1ccc(-c2nc(SCC(=O)[O-])cc(-c3ccncc3)n2)cc1	ZINC000073695520	202372388	/nfs/dbraw/zinc/37/23/88/202372388.db2.gz	MXEXJKSYGQRQKP-UHFFFAOYSA-N	-1	0	337.404	3.691	10	0		EHAERM
O=C([O-])[C@H](NCc1cccs1)c1cc(Br)ccc1F	ZINC000037966569	202381189	/nfs/dbraw/zinc/38/11/89/202381189.db2.gz	RRCICNBXUYFULQ-GFCCVEGCSA-N	-1	0	344.205	3.565	10	0		EHAERM
O=C([O-])c1[nH]c2ccc(Cl)cc2c1CC(=O)Nc1ccccc1F	ZINC000004920264	201626569	/nfs/dbraw/zinc/62/65/69/201626569.db2.gz	HNULUAIBCXMWFM-UHFFFAOYSA-N	-1	0	346.745	3.840	10	0		EHAERM
CC[C@@H](C(=O)[O-])n1cnc2sc3c(c2c1=O)CC[C@@H](C(C)(C)C)C3	ZINC000005673980	201659607	/nfs/dbraw/zinc/65/96/07/201659607.db2.gz	XLNNASQHUQGUCG-PWSUYJOCSA-N	-1	0	348.468	3.645	10	0		EHAERM
CCc1c(C)nc(-c2ccc(C)cc2)nc1N1CCCC[C@@H]1C(=O)[O-]	ZINC000070452151	203075904	/nfs/dbraw/zinc/07/59/04/203075904.db2.gz	POUSOKLAENXLLL-QGZVFWFLSA-N	-1	0	339.439	3.766	10	0		EHAERM
O=C([O-])CCc1ncc(-c2cc3cc(Br)ccc3o2)o1	ZINC000019387402	212024507	/nfs/dbraw/zinc/02/45/07/212024507.db2.gz	QLCQQJZCOOAQCI-UHFFFAOYSA-N	-1	0	336.141	3.868	10	0		EHAERM
CC(C)c1nn2c([n-]1)nc(CSc1cccc(F)c1F)cc2=O	ZINC000103236988	204069583	/nfs/dbraw/zinc/06/95/83/204069583.db2.gz	GCVSEUGOYPGLRZ-UHFFFAOYSA-N	-1	0	336.367	3.524	10	0		EHAERM
CC(C)N(C)c1nc2cc(C(=O)[O-])ccc2nc1-c1ccc(F)cc1	ZINC000116231803	563930645	/nfs/dbraw/zinc/93/06/45/563930645.db2.gz	JKKRYYTVQXUOKL-UHFFFAOYSA-N	-1	0	339.370	3.979	10	0		EHAERM
O=[S@]([O-])c1ccc(OCc2ccccc2)c(Br)c1	ZINC000675062301	564112366	/nfs/dbraw/zinc/11/23/66/564112366.db2.gz	BECODZVTWJFKMF-UHFFFAOYSA-N	-1	0	327.199	3.609	10	0		EHAERM
CC(C)(C)[C@@H]1CCCC[C@@]1(NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000226769090	564118246	/nfs/dbraw/zinc/11/82/46/564118246.db2.gz	ZEHMJQJVAHUPOO-KXBFYZLASA-N	-1	0	333.428	3.973	10	0		EHAERM
C[C@]1(C(=O)[O-])CCCN1Cc1cccc(Cl)c1Br	ZINC000719414051	969105345	/nfs/dbraw/zinc/10/53/45/969105345.db2.gz	QWJFCOCUESNUSS-CYBMUJFWSA-N	-1	0	332.625	3.542	10	0		EHAERM
O=C([O-])c1cc(CNCc2ccsc2Br)cs1	ZINC000689079663	976207179	/nfs/dbraw/zinc/20/71/79/976207179.db2.gz	XUDMBBVXICLGNW-UHFFFAOYSA-N	-1	0	332.244	3.560	10	0		EHAERM
O=C([O-])CN(Cc1ccccc1)C(=O)c1cc2c(s1)CCCCC2	ZINC000692406032	976446874	/nfs/dbraw/zinc/44/68/74/976446874.db2.gz	XHSUVGGVYLZNBU-UHFFFAOYSA-N	-1	0	343.448	3.744	10	0		EHAERM
Cc1c2ccccc2oc1C(=O)N(CCC(=O)[O-])Cc1ccccc1	ZINC000692408959	976450392	/nfs/dbraw/zinc/45/03/92/976450392.db2.gz	PQCWPIDOJSSEAC-UHFFFAOYSA-N	-1	0	337.375	3.858	10	0		EHAERM
Cc1cc(Br)c(C(=O)[O-])cc1NC(=O)[C@H](C)C1CCC1	ZINC000692716987	976538393	/nfs/dbraw/zinc/53/83/93/976538393.db2.gz	BSTBUJGNVGZCET-SECBINFHSA-N	-1	0	340.217	3.830	10	0		EHAERM
CC(C)n1ccc(COc2cc(Br)cc(C(=O)[O-])c2)n1	ZINC000700708067	976963994	/nfs/dbraw/zinc/96/39/94/976963994.db2.gz	AYSMQHJVBKKJFO-UHFFFAOYSA-N	-1	0	339.189	3.504	10	0		EHAERM
Cc1nc(COc2cc(Br)cc(C(=O)[O-])c2)sc1C	ZINC000700751627	976968291	/nfs/dbraw/zinc/96/82/91/976968291.db2.gz	GXVREBHSSJBIFT-UHFFFAOYSA-N	-1	0	342.214	3.800	10	0		EHAERM
O=C([O-])C[C@@H]1CCCCN1Cc1cccc(Br)c1Cl	ZINC000706413965	977315028	/nfs/dbraw/zinc/31/50/28/977315028.db2.gz	JXBGQIKWBCVSOC-NSHDSACASA-N	-1	0	346.652	3.932	10	0		EHAERM
Cc1c(Br)cncc1NCc1ccc(C(=O)[O-])c(F)c1	ZINC000722724771	978165448	/nfs/dbraw/zinc/16/54/48/978165448.db2.gz	QPNIXFBIMKYEEQ-UHFFFAOYSA-N	-1	0	339.164	3.602	10	0		EHAERM
Nc1nc(-c2ccccc2OCc2cccc(C(=O)[O-])c2)cs1	ZINC000020332045	202037882	/nfs/dbraw/zinc/03/78/82/202037882.db2.gz	GSPUVXPTODDTKA-UHFFFAOYSA-N	-1	0	326.377	3.670	10	0		EHAERM
COc1ccccc1C(=O)Nc1sc2c(c1C(=O)[O-])CC[C@@H](C)C2	ZINC000020333627	202039381	/nfs/dbraw/zinc/03/93/81/202039381.db2.gz	IBYQLBSZAOWRIT-SNVBAGLBSA-N	-1	0	345.420	3.832	10	0		EHAERM
COc1ccc(C(=O)Nc2sc3c(c2C(=O)[O-])CC[C@H](C)C3)cc1	ZINC000020333634	202039442	/nfs/dbraw/zinc/03/94/42/202039442.db2.gz	VKUBTRATEGNOHF-JTQLQIEISA-N	-1	0	345.420	3.832	10	0		EHAERM
CC[C@@H](C)Oc1c(Br)cc(/C=C/C(=O)[O-])cc1OC	ZINC000036815562	202331482	/nfs/dbraw/zinc/33/14/82/202331482.db2.gz	DDRWTVXXLWTAHK-VUHVRTRXSA-N	-1	0	329.190	3.733	10	0		EHAERM
O=C([O-])CSc1cc(-c2ccncc2)nc(-c2ccccc2F)n1	ZINC000073695572	202372270	/nfs/dbraw/zinc/37/22/70/202372270.db2.gz	VHKDDVHCHHSOGF-UHFFFAOYSA-N	-1	0	341.367	3.521	10	0		EHAERM
CCCCc1sc(NC(=O)/C=C/C(=O)[O-])nc1-c1ccccc1	ZINC000059482626	202777868	/nfs/dbraw/zinc/77/78/68/202777868.db2.gz	ILFOFKKJKOQSKK-ZHACJKMWSA-N	-1	0	330.409	3.732	10	0		EHAERM
Cc1cccc(-c2c(C(=O)[O-])nnn2Cc2cccc(Cl)c2)c1	ZINC000070457156	203076932	/nfs/dbraw/zinc/07/69/32/203076932.db2.gz	YWPQTEIHNDTDJN-UHFFFAOYSA-N	-1	0	327.771	3.653	10	0		EHAERM
Cc1ccc(Cn2nnc(C(=O)[O-])c2-c2cccc(Cl)c2)cc1	ZINC000070457069	203077364	/nfs/dbraw/zinc/07/73/64/203077364.db2.gz	RLSKEXISTSCFAL-UHFFFAOYSA-N	-1	0	327.771	3.653	10	0		EHAERM
C[C@H]1C[C@H](Nc2ccccc2)c2ccccc2N1C(=O)CCC(=O)[O-]	ZINC000004561469	135664549	/nfs/dbraw/zinc/66/45/49/135664549.db2.gz	STNRBABUYVLMIL-YOEHRIQHSA-N	-1	0	338.407	3.830	10	0		EHAERM
CC[C@H]1CCc2c(sc(I)c2C(=O)[O-])C1	ZINC000725246497	563976142	/nfs/dbraw/zinc/97/61/42/563976142.db2.gz	NYZBWXXWWKPLIH-LURJTMIESA-N	-1	0	336.194	3.566	10	0		EHAERM
CC(C)(C(=O)[O-])[C@@H](NC(=O)OCc1ccccc1)c1ccc(F)cc1	ZINC000536959730	564091786	/nfs/dbraw/zinc/09/17/86/564091786.db2.gz	SSXICQOJNWCBGV-INIZCTEOSA-N	-1	0	345.370	3.904	10	0		EHAERM
C[C@@H]1C[C@H](NC(=O)OCc2ccccc2)c2c1c(F)ccc2C(=O)[O-]	ZINC000536959911	564091800	/nfs/dbraw/zinc/09/18/00/564091800.db2.gz	LWSAVCBZWQWLEV-ABAIWWIYSA-N	-1	0	343.354	3.999	10	0		EHAERM
CCCCN(C)c1ncc(NC(=O)c2ccc(C)cc2)cc1C(=O)[O-]	ZINC000064978465	564098852	/nfs/dbraw/zinc/09/88/52/564098852.db2.gz	FSPUHLMNEDCVCF-UHFFFAOYSA-N	-1	0	341.411	3.577	10	0		EHAERM
CC(C)c1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C(=O)[O-])cc1	ZINC000098091557	219082825	/nfs/dbraw/zinc/08/28/25/219082825.db2.gz	JDEWSAXOVLKJBE-HOTGVXAUSA-N	-1	0	333.428	3.845	10	0		EHAERM
COc1ccc(-c2nc3ccccc3c(C(=O)[O-])c2-n2cccn2)cc1	ZINC000011850199	201815980	/nfs/dbraw/zinc/81/59/80/201815980.db2.gz	NCESDEVJVTTYRN-UHFFFAOYSA-N	-1	0	345.358	3.794	10	0		EHAERM
Cc1ccccc1N1C(=O)S/C(=C/c2ccccc2C(=O)[O-])C1=O	ZINC000016905135	201982126	/nfs/dbraw/zinc/98/21/26/201982126.db2.gz	GWUDVVVBCOUFFL-XNTDXEJSSA-N	-1	0	339.372	3.934	10	0		EHAERM
O=C([O-])c1nc(Nc2ccccc2Br)ccc1Cl	ZINC000019965958	202029240	/nfs/dbraw/zinc/02/92/40/202029240.db2.gz	XQPUXRKSXRISDJ-UHFFFAOYSA-N	-1	0	327.565	3.939	10	0		EHAERM
Cc1cc(Cl)cc(NC(=O)Cc2ccc(O[C@@H](C)C(=O)[O-])cc2)c1	ZINC000027526185	202156511	/nfs/dbraw/zinc/15/65/11/202156511.db2.gz	DJOLXKNVIMVTDH-LBPRGKRZSA-N	-1	0	347.798	3.682	10	0		EHAERM
CC(C)[C@](C)(Cc1nc2cc(Br)ccc2[nH]1)C(=O)[O-]	ZINC000037441018	202342047	/nfs/dbraw/zinc/34/20/47/202342047.db2.gz	IRTMBNCGFSZYQS-AWEZNQCLSA-N	-1	0	325.206	3.615	10	0		EHAERM
Cc1c(Cl)cccc1Nc1nc2c(c(OCC(=O)[O-])n1)CCCC2	ZINC000073704172	202371652	/nfs/dbraw/zinc/37/16/52/202371652.db2.gz	JXZHPKDFXFLHLL-UHFFFAOYSA-N	-1	0	347.802	3.524	10	0		EHAERM
Nc1cc(C(=O)[O-])ccc1Oc1ccc(F)cc1Br	ZINC000037933310	202379465	/nfs/dbraw/zinc/37/94/65/202379465.db2.gz	QBYGZJTXAZYUBA-UHFFFAOYSA-N	-1	0	326.121	3.661	10	0		EHAERM
CCc1nc(-c2ccncc2)nc(Nc2cccc(C(=O)[O-])c2)c1C	ZINC000073683668	202370873	/nfs/dbraw/zinc/37/08/73/202370873.db2.gz	DSQSARWSGWKQIL-UHFFFAOYSA-N	-1	0	334.379	3.851	10	0		EHAERM
Cc1cc(C)cc(Nc2ncnc(Nc3ccc(C(=O)[O-])cc3)c2N)c1	ZINC000040682257	202458645	/nfs/dbraw/zinc/45/86/45/202458645.db2.gz	UUFHQPSEMZJWSY-UHFFFAOYSA-N	-1	0	349.394	3.861	10	0		EHAERM
Cc1ccc(S(=O)(=O)[N-]c2cccnc2Nc2ccccc2)cc1	ZINC000026567965	201386492	/nfs/dbraw/zinc/38/64/92/201386492.db2.gz	XGEPEZXKPDYNEA-UHFFFAOYSA-N	-1	0	339.420	3.934	10	0		EHAERM
Cc1c(Br)c(C(=O)[O-])nn1-c1ccc(Cl)c(Cl)c1	ZINC000049899224	202628676	/nfs/dbraw/zinc/62/86/76/202628676.db2.gz	YHEAEJYYPJODHR-UHFFFAOYSA-N	-1	0	349.999	3.948	10	0		EHAERM
CCc1c(C)nc(-c2ccc(Cl)cc2)nc1-n1cnc(C(=O)[O-])c1	ZINC000070452552	203076795	/nfs/dbraw/zinc/07/67/95/203076795.db2.gz	FDYWSQSSUMIRNA-UHFFFAOYSA-N	-1	0	342.786	3.552	10	0		EHAERM
O=C([O-])c1nnn(Cc2ccc(Cl)cc2)c1-c1ccc(Cl)cc1	ZINC000070457101	203076870	/nfs/dbraw/zinc/07/68/70/203076870.db2.gz	WKQRBSATDHVEQC-UHFFFAOYSA-N	-1	0	348.189	3.998	10	0		EHAERM
Cc1ccc(-c2noc(-c3cc4ccccc4n3CC(=O)[O-])n2)cc1	ZINC000070458699	203077303	/nfs/dbraw/zinc/07/73/03/203077303.db2.gz	KWYPOSHXJZWZMO-UHFFFAOYSA-N	-1	0	333.347	3.751	10	0		EHAERM
C=Cc1ccc(Cn2cc(C(=O)[O-])c(=O)c3cc(F)c(F)cc32)cc1	ZINC000070460720	203078348	/nfs/dbraw/zinc/07/83/48/203078348.db2.gz	LHSFOWJRBPKSTQ-UHFFFAOYSA-N	-1	0	341.313	3.669	10	0		EHAERM
CC[C@H]1CCC[C@@](CNC(=O)OCc2ccccc2)(C(=O)[O-])CC1	ZINC000725245882	563976096	/nfs/dbraw/zinc/97/60/96/563976096.db2.gz	YUNNBBOFSKYWMW-HNAYVOBHSA-N	-1	0	333.428	3.974	10	0		EHAERM
CC1=CCC[C@H](C)[C@H]1C[C@H](CNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000725245810	563976104	/nfs/dbraw/zinc/97/61/04/563976104.db2.gz	IEZHDBAGFIAKNW-JQHSSLGASA-N	-1	0	345.439	3.996	10	0		EHAERM
COc1cccc2c1N(C(=O)OC(C)(C)C)[C@@H](C)C[C@H]2CC(=O)[O-]	ZINC000725253643	563982173	/nfs/dbraw/zinc/98/21/73/563982173.db2.gz	CHHWYIJJOZAFBE-RYUDHWBXSA-N	-1	0	335.400	3.787	10	0		EHAERM
O=C([O-])[C@@H](CNc1nc2cc(Br)ccc2o1)CC1CC1	ZINC000705845143	977296367	/nfs/dbraw/zinc/29/63/67/977296367.db2.gz	MMQOLGZFWCFDCF-SECBINFHSA-N	-1	0	339.189	3.503	10	0		EHAERM
Cc1cc(COc2c(F)cccc2Br)oc1C(=O)[O-]	ZINC000707056452	977374589	/nfs/dbraw/zinc/37/45/89/977374589.db2.gz	OAWYIBLAJRQPFL-UHFFFAOYSA-N	-1	0	329.121	3.767	10	0		EHAERM
O=C([O-])c1occc1COc1cc(Cl)ccc1Br	ZINC000708103348	977415433	/nfs/dbraw/zinc/41/54/33/977415433.db2.gz	ZPOXVGRFBNSBSU-UHFFFAOYSA-N	-1	0	331.549	3.973	10	0		EHAERM
CN(Cc1cscc1Br)c1ccccc1C(=O)[O-]	ZINC000709929377	977472773	/nfs/dbraw/zinc/47/27/73/977472773.db2.gz	GIICBQXJTFLKCP-UHFFFAOYSA-N	-1	0	326.215	3.845	10	0		EHAERM
COc1cc(Br)ccc1NCc1cccc(C(=O)[O-])c1	ZINC000712286209	977578883	/nfs/dbraw/zinc/57/88/83/977578883.db2.gz	MMUVXDVIRNASLR-UHFFFAOYSA-N	-1	0	336.185	3.768	10	0		EHAERM
Cc1c(C(=O)[O-])oc2c1-c1nn(Cc3ccc(Cl)cc3)cc1CC2	ZINC000006751393	201694411	/nfs/dbraw/zinc/69/44/11/201694411.db2.gz	CKJUOOCPNSKESC-UHFFFAOYSA-N	-1	0	342.782	3.950	10	0		EHAERM
CC(C)c1ccc(-c2csc3ncn([C@@H](C)C(=O)[O-])c(=O)c23)cc1	ZINC000019955277	202027830	/nfs/dbraw/zinc/02/78/30/202027830.db2.gz	NXRLZDLRYYSOIN-NSHDSACASA-N	-1	0	342.420	3.894	10	0		EHAERM
O=C([O-])c1c2c(sc1NC(=O)C(Cl)(Cl)Cl)CCCC2	ZINC000020333495	202039551	/nfs/dbraw/zinc/03/95/51/202039551.db2.gz	QRSZRLINEFBCHR-UHFFFAOYSA-N	-1	0	342.631	3.634	10	0		EHAERM
O=S(=O)([N-]c1ccccc1C(F)(F)F)c1ccnc(Cl)c1	ZINC000038008499	202082298	/nfs/dbraw/zinc/08/22/98/202082298.db2.gz	UDKNWLSOTLXLFU-UHFFFAOYSA-N	-1	0	336.722	3.555	10	0		EHAERM
O=C([O-])[C@H](NC(=O)c1cc(Cl)cc(Cl)c1)C1CCCCC1	ZINC000038036113	202091387	/nfs/dbraw/zinc/09/13/87/202091387.db2.gz	RYWPJYNOICUVCZ-CYBMUJFWSA-N	-1	0	330.211	3.757	10	0		EHAERM
O=C([O-])[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1)C1CCCCC1	ZINC000038036112	202091408	/nfs/dbraw/zinc/09/14/08/202091408.db2.gz	RYWPJYNOICUVCZ-ZDUSSCGKSA-N	-1	0	330.211	3.757	10	0		EHAERM
Cc1nc(Nc2ccc(Br)c(C)c2)sc1C(=O)[O-]	ZINC000033507795	202262932	/nfs/dbraw/zinc/26/29/32/202262932.db2.gz	NUFWBCUYFPJRIJ-UHFFFAOYSA-N	-1	0	327.203	3.964	10	0		EHAERM
Cc1cc(Br)ccc1Nc1nc(CC(=O)[O-])cs1	ZINC000033507710	202263020	/nfs/dbraw/zinc/26/30/20/202263020.db2.gz	VWFQYROHDPSUIS-UHFFFAOYSA-N	-1	0	327.203	3.585	10	0		EHAERM
Cc1ccc(Nc2nc3c(c(OCC(=O)[O-])n2)CCCC3)c(Cl)c1	ZINC000073704435	202371517	/nfs/dbraw/zinc/37/15/17/202371517.db2.gz	AFSLAFPOPDZXRO-UHFFFAOYSA-N	-1	0	347.802	3.524	10	0		EHAERM
CCc1cccc(Nc2nc(OCC(=O)[O-])cc(C(C)(C)C)n2)c1	ZINC000073697673	202371790	/nfs/dbraw/zinc/37/17/90/202371790.db2.gz	LLZYOPQGPBFZHX-UHFFFAOYSA-N	-1	0	329.400	3.544	10	0		EHAERM
CSc1cccc(Nc2nc(OCC(=O)[O-])cc(C(C)C)n2)c1	ZINC000073700106	202371953	/nfs/dbraw/zinc/37/19/53/202371953.db2.gz	GURUCJHBUSCAFN-UHFFFAOYSA-N	-1	0	333.413	3.529	10	0		EHAERM
COCc1cc(Oc2cccc(C(=O)[O-])c2)nc(-c2ccccc2)n1	ZINC000045947192	201104895	/nfs/dbraw/zinc/10/48/95/201104895.db2.gz	NYNRCEYGTBUMQW-UHFFFAOYSA-N	-1	0	336.347	3.781	10	0		EHAERM
Cc1cc(C)c2c(-n3cccc3)nn(Cc3ccc(C(=O)[O-])cc3)c2n1	ZINC000049454649	202622494	/nfs/dbraw/zinc/62/24/94/202622494.db2.gz	QHYQCEBODXISQI-UHFFFAOYSA-N	-1	0	346.390	3.585	10	0		EHAERM
O=C([O-])C1CCN(C(=O)/C(=C/c2ccccc2)c2ccccc2)CC1	ZINC000058827538	202772829	/nfs/dbraw/zinc/77/28/29/202772829.db2.gz	BKYJNPKOWNMIRX-XDJHFCHBSA-N	-1	0	335.403	3.550	10	0		EHAERM
Cc1cc(N2CCCC[C@H]2C(=O)[O-])nc(-c2cccc(Cl)c2)n1	ZINC000070452230	203075314	/nfs/dbraw/zinc/07/53/14/203075314.db2.gz	HVYJVFITBRYLKU-AWEZNQCLSA-N	-1	0	331.803	3.549	10	0		EHAERM
O=C([O-])c1nnn(Cc2cc(F)cc(F)c2)c1-c1cccc(Cl)c1	ZINC000070457075	203076417	/nfs/dbraw/zinc/07/64/17/203076417.db2.gz	KSVWOWRGXGVYNW-UHFFFAOYSA-N	-1	0	349.724	3.623	10	0		EHAERM
CCc1c(C)nc(-c2ccncc2)nc1Nc1ccc(C(=O)[O-])cc1	ZINC000070455649	203076588	/nfs/dbraw/zinc/07/65/88/203076588.db2.gz	PIGUERSOVYNRTA-UHFFFAOYSA-N	-1	0	334.379	3.851	10	0		EHAERM
Cc1ccc(-c2c(C(=O)[O-])nnn2Cc2ccc(Cl)cc2)cc1	ZINC000070457139	203077432	/nfs/dbraw/zinc/07/74/32/203077432.db2.gz	VQRLMZIJNPISFO-UHFFFAOYSA-N	-1	0	327.771	3.653	10	0		EHAERM
Cc1ccc(C)c(OCC(=O)Nc2sc3c(c2C(=O)[O-])CCC3)c1	ZINC000020334717	212120326	/nfs/dbraw/zinc/12/03/26/212120326.db2.gz	NJKYVMCZFCSQCD-UHFFFAOYSA-N	-1	0	345.420	3.569	10	0		EHAERM
CC1CCC(CNc2ncc(Br)cc2C(=O)[O-])CC1	ZINC000104184505	204100637	/nfs/dbraw/zinc/10/06/37/204100637.db2.gz	VVWWQEGPGSNMNP-UHFFFAOYSA-N	-1	0	327.222	3.781	10	0		EHAERM
C[C@H](CC(=O)[O-])[C@@H](c1ccccc1)N(C=O)Cc1ccccc1F	ZINC000514250869	257844991	/nfs/dbraw/zinc/84/49/91/257844991.db2.gz	USFXHMYLDPTJLO-KUHUBIRLSA-N	-1	0	329.371	3.636	10	0		EHAERM
O=C([O-])[C@H]1CCC(=O)N(c2ccccc2)[C@@H]1c1ccc(Cl)cc1	ZINC000049452856	132431259	/nfs/dbraw/zinc/43/12/59/132431259.db2.gz	SXUBJRJCRQCMES-DOTOQJQBSA-N	-1	0	329.783	3.909	10	0		EHAERM
Cc1ccc2nc(-c3ccccc3)c(N3CCOCC3)c(C(=O)[O-])c2c1	ZINC000011850062	135691033	/nfs/dbraw/zinc/69/10/33/135691033.db2.gz	YXXYUOBGEXXLJD-UHFFFAOYSA-N	-1	0	348.402	3.745	10	0		EHAERM
CC[C@@H]1CCC[C@@](CNC(=O)OCc2ccccc2)(C(=O)[O-])CC1	ZINC000725245881	563976091	/nfs/dbraw/zinc/97/60/91/563976091.db2.gz	YUNNBBOFSKYWMW-DNVCBOLYSA-N	-1	0	333.428	3.974	10	0		EHAERM
CC[C@]1(C(=O)[O-])C[C@H](C2CC2)C[C@H]1NC(=O)OCc1ccccc1	ZINC000685958791	564177064	/nfs/dbraw/zinc/17/70/64/564177064.db2.gz	GOYWLRYGLZWYEK-MDZRGWNJSA-N	-1	0	331.412	3.582	10	0		EHAERM
CC(C)c1ccc(-n2cc([O-])c(C(=O)N3CC[C@@H]4CCC[C@@H]43)n2)cc1	ZINC000330251117	1042554898	/nfs/dbraw/zinc/55/48/98/1042554898.db2.gz	NGLACAQLWJHLIH-RDJZCZTQSA-N	-1	0	339.439	3.716	10	0		EHAERM
Cc1nc2scc(-c3ccc(C(C)C)cc3)c2c(=O)n1CC(=O)[O-]	ZINC000019955741	202027293	/nfs/dbraw/zinc/02/72/93/202027293.db2.gz	BGWQGJOLXIELIH-UHFFFAOYSA-N	-1	0	342.420	3.641	10	0		EHAERM
O=C([O-])CCCc1nnc(-c2cc(Br)ccc2Cl)o1	ZINC000037729453	202355702	/nfs/dbraw/zinc/35/57/02/202355702.db2.gz	GGTJNVRVDJHEQB-UHFFFAOYSA-N	-1	0	345.580	3.560	10	0		EHAERM
Cc1nc(-c2ccc(C(F)(F)F)cc2)nc(SCC(=O)[O-])c1C	ZINC000073695727	202371811	/nfs/dbraw/zinc/37/18/11/202371811.db2.gz	RKPJUNQUIIEUOR-UHFFFAOYSA-N	-1	0	342.342	3.956	10	0		EHAERM
Cc1ccc(Nc2nc(OCC(=O)[O-])cc(C(C)(C)C)n2)cc1C	ZINC000073697375	202371875	/nfs/dbraw/zinc/37/18/75/202371875.db2.gz	YJSCCZFXWUWOAL-UHFFFAOYSA-N	-1	0	329.400	3.598	10	0		EHAERM
Nc1ccc(Nc2ccc(F)cc2Br)c(C(=O)[O-])c1	ZINC000037930738	202380283	/nfs/dbraw/zinc/38/02/83/202380283.db2.gz	XKZZMPXEMDSNHY-UHFFFAOYSA-N	-1	0	325.137	3.612	10	0		EHAERM
CC(C)c1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C(=O)[O-])cc1	ZINC000066339916	202885728	/nfs/dbraw/zinc/88/57/28/202885728.db2.gz	JDEWSAXOVLKJBE-JKSUJKDBSA-N	-1	0	333.428	3.845	10	0		EHAERM
Cc1ccc(-n2nnc(C(=O)[O-])c2-c2cccc(Cl)c2)cc1F	ZINC000070456796	203076557	/nfs/dbraw/zinc/07/65/57/203076557.db2.gz	IFEJAQOGCDXCJN-UHFFFAOYSA-N	-1	0	331.734	3.733	10	0		EHAERM
CC(C)c1cc(N2CCCC[C@@H]2C(=O)[O-])nc(-c2ccc(F)cc2)n1	ZINC000070452239	203076783	/nfs/dbraw/zinc/07/67/83/203076783.db2.gz	SOIBVCCQRBOZTF-MRXNPFEDSA-N	-1	0	343.402	3.850	10	0		EHAERM
CC1(C)[C@H]2CC[C@@]13CSN(C(=O)c1ccccc1C(=O)[O-])[C@@H]3C2	ZINC000044075863	203449039	/nfs/dbraw/zinc/44/90/39/203449039.db2.gz	WQQBUPWCENQXFU-FVMIAERFSA-N	-1	0	331.437	3.684	10	0		EHAERM
O=C([O-])c1cc(-c2ccncc2)nc2cc(Br)ccc21	ZINC000019512613	212035807	/nfs/dbraw/zinc/03/58/07/212035807.db2.gz	CJMLIEBLZHEOFF-UHFFFAOYSA-N	-1	0	329.153	3.758	10	0		EHAERM
Cc1cccc(-c2cc(OCC(=O)[O-])nc(NCc3ccccc3)n2)c1	ZINC000073705204	524107366	/nfs/dbraw/zinc/10/73/66/524107366.db2.gz	UVVTWLHQXLQAOL-UHFFFAOYSA-N	-1	0	349.390	3.528	10	0		EHAERM
COc1cc(/C=C/C(=O)OC(C)(C)C)cc(Br)c1O	ZINC000406025756	563930662	/nfs/dbraw/zinc/93/06/62/563930662.db2.gz	QPPOPQPTGRLOOL-AATRIKPKSA-N	-1	0	329.190	3.518	10	0		EHAERM
CCCOc1nc2c(F)cc(Br)c(C)c2cc1C(=O)[O-]	ZINC000675051903	564052401	/nfs/dbraw/zinc/05/24/01/564052401.db2.gz	WZDMKKAPUGDVOO-UHFFFAOYSA-N	-1	0	342.164	3.932	10	0		EHAERM
CCN(C(=O)Nc1ccc(OCc2ccccc2)cc1)[C@@H](C)C(=O)[O-]	ZINC000707951202	969029180	/nfs/dbraw/zinc/02/91/80/969029180.db2.gz	ZBVCHNKNKYWMMH-AWEZNQCLSA-N	-1	0	342.395	3.593	10	0		EHAERM
O=C([O-])CN(Cc1csc(Br)c1)Cc1ccccc1	ZINC000692435580	976474919	/nfs/dbraw/zinc/47/49/19/976474919.db2.gz	CFTHCOYXTLJCTI-UHFFFAOYSA-N	-1	0	340.242	3.597	10	0		EHAERM
Cc1cc(C(=O)Nc2cc(C)ccc2Br)oc1C(=O)[O-]	ZINC000704798971	977260211	/nfs/dbraw/zinc/26/02/11/977260211.db2.gz	VPBQXDHQVPNKJT-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
CC(C)(CNc1nc2cc(Br)ccc2o1)CC(=O)[O-]	ZINC000720923684	978085968	/nfs/dbraw/zinc/08/59/68/978085968.db2.gz	LJOSQMGILXZPKT-UHFFFAOYSA-N	-1	0	327.178	3.503	10	0		EHAERM
C[C@@H](c1ccccc1Br)N(C)Cc1ccc(C(=O)[O-])o1	ZINC000724843582	978245559	/nfs/dbraw/zinc/24/55/59/978245559.db2.gz	JZJHUKCWRWCNPG-JTQLQIEISA-N	-1	0	338.201	3.933	10	0		EHAERM
Cc1cc(C(=O)N2C[C@@H](C(=O)[O-])C[C@@H](c3ccccc3)C2)sc1C	ZINC000180313512	1031878073	/nfs/dbraw/zinc/87/80/73/1031878073.db2.gz	NGIUOTORIGWYRU-CVEARBPZSA-N	-1	0	343.448	3.695	10	0		EHAERM
O=C([O-])c1ccc(CCC(=O)N2CC=C(c3ccccc3)CC2)cc1	ZINC000181914916	1032042795	/nfs/dbraw/zinc/04/27/95/1032042795.db2.gz	GELCTGQFHHHCCC-UHFFFAOYSA-N	-1	0	335.403	3.633	10	0		EHAERM
CCSc1n[n-]c(=NC(=O)N2CCCC3(CCCCC3)C2)s1	ZINC000408140841	1041778040	/nfs/dbraw/zinc/77/80/40/1041778040.db2.gz	RZSWESVHZZBAMH-UHFFFAOYSA-N	-1	0	340.518	3.650	10	0		EHAERM
O=C([O-])/C(=C\c1ccc(F)cc1)SCC(=O)Nc1ccc(F)cc1	ZINC000015055556	201949060	/nfs/dbraw/zinc/94/90/60/201949060.db2.gz	GTEIMJWXYPZPMP-OQLLNIDSSA-N	-1	0	349.358	3.762	10	0		EHAERM
O=C([O-])[C@@H]1CCCN(C(=O)/C(=C\c2ccccc2)c2ccccc2)C1	ZINC000020200236	202035187	/nfs/dbraw/zinc/03/51/87/202035187.db2.gz	QYLWHVNLKOVGPF-GXYBQNOFSA-N	-1	0	335.403	3.550	10	0		EHAERM
COc1ccccc1C(=O)Nc1sc2c(c1C(=O)[O-])CC[C@H](C)C2	ZINC000020333624	202039643	/nfs/dbraw/zinc/03/96/43/202039643.db2.gz	IBYQLBSZAOWRIT-JTQLQIEISA-N	-1	0	345.420	3.832	10	0		EHAERM
CC(C)(C)[C@H]1CCc2c(sc3ncnc(NCCC(=O)[O-])c32)C1	ZINC000020314425	202038469	/nfs/dbraw/zinc/03/84/69/202038469.db2.gz	BCWCWRHINCSVHX-JTQLQIEISA-N	-1	0	333.457	3.729	10	0		EHAERM
CSc1ccc(C(=O)c2cc(Cl)cc(CC(=O)[O-])c2N)cc1	ZINC000028770799	202176603	/nfs/dbraw/zinc/17/66/03/202176603.db2.gz	SOVJXDNFKOBZQF-UHFFFAOYSA-N	-1	0	335.812	3.502	10	0		EHAERM
Cc1cc(Nc2nc(CC(=O)[O-])cs2)ccc1Br	ZINC000033507712	202263114	/nfs/dbraw/zinc/26/31/14/202263114.db2.gz	XPCDOISNQDZQMG-UHFFFAOYSA-N	-1	0	327.203	3.585	10	0		EHAERM
CC(C)(C)n1c2ccc(Br)cc2nc1SCC(=O)[O-]	ZINC000036898917	202333282	/nfs/dbraw/zinc/33/32/82/202333282.db2.gz	DWEQOLIKMXVRBW-UHFFFAOYSA-N	-1	0	343.246	3.731	10	0		EHAERM
CCc1c(C)nc(Nc2cc(Cl)ccc2C)nc1OCC(=O)[O-]	ZINC000073704367	202371718	/nfs/dbraw/zinc/37/17/18/202371718.db2.gz	WXPMJPRVAOEWEB-UHFFFAOYSA-N	-1	0	335.791	3.516	10	0		EHAERM
Cc1nc(Nc2ccc(Cl)c(Cl)c2)nc(OCC(=O)[O-])c1C	ZINC000073702857	202371957	/nfs/dbraw/zinc/37/19/57/202371957.db2.gz	DYAFFTCCGBVXHE-UHFFFAOYSA-N	-1	0	342.182	3.607	10	0		EHAERM
CCc1cc(SCC(=O)[O-])nc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000073695720	202371965	/nfs/dbraw/zinc/37/19/65/202371965.db2.gz	XAYVYBBSCAHOIT-UHFFFAOYSA-N	-1	0	342.342	3.902	10	0		EHAERM
Cc1nc(Nc2cc(Cl)ccc2Cl)nc(OCC(=O)[O-])c1C	ZINC000073702696	202372072	/nfs/dbraw/zinc/37/20/72/202372072.db2.gz	CEPADMGLYUYAJA-UHFFFAOYSA-N	-1	0	342.182	3.607	10	0		EHAERM
O=C([O-])c1ccc([S@](=O)Cc2ccc(Br)s2)cc1	ZINC000037923138	202377883	/nfs/dbraw/zinc/37/78/83/202377883.db2.gz	ZUWUKMIZFSSZOY-SFHVURJKSA-N	-1	0	345.239	3.517	10	0		EHAERM
CCc1c(C)nc(-c2ccccc2F)nc1N1CCCC[C@H]1C(=O)[O-]	ZINC000070452180	203075444	/nfs/dbraw/zinc/07/54/44/203075444.db2.gz	IOMVKGCWERBJNQ-INIZCTEOSA-N	-1	0	343.402	3.597	10	0		EHAERM
Cc1nc(-c2cccc(Cl)c2)nc(N2CCCC[C@H]2C(=O)[O-])c1C	ZINC000070452234	203076582	/nfs/dbraw/zinc/07/65/82/203076582.db2.gz	JJAWSADMVXNJEZ-HNNXBMFYSA-N	-1	0	345.830	3.857	10	0		EHAERM
CCCc1cc(-n2cnc(C(=O)[O-])c2)nc(-c2ccc(Cl)cc2)n1	ZINC000070452549	203076706	/nfs/dbraw/zinc/07/67/06/203076706.db2.gz	ZYGXQVFXXONWEQ-UHFFFAOYSA-N	-1	0	342.786	3.633	10	0		EHAERM
CCCc1cc(N2CCC(C(=O)[O-])CC2)nc(-c2ccccc2F)n1	ZINC000070452695	203077342	/nfs/dbraw/zinc/07/73/42/203077342.db2.gz	HVXXLTMCTAWMKB-UHFFFAOYSA-N	-1	0	343.402	3.536	10	0		EHAERM
O=C([O-])c1cn(Cc2ccc(Cl)cc2)c2cc(F)c(F)cc2c1=O	ZINC000070460726	203078582	/nfs/dbraw/zinc/07/85/82/203078582.db2.gz	CMFDACZRVXWGAL-UHFFFAOYSA-N	-1	0	349.720	3.680	10	0		EHAERM
O=c1c2sccc2[n-]c(=S)n1CCN1CCCc2ccccc21	ZINC000070460351	203078689	/nfs/dbraw/zinc/07/86/89/203078689.db2.gz	GTMLGTNOWLQLPN-UHFFFAOYSA-N	-1	0	343.477	3.573	10	0		EHAERM
Cc1ccc2nc([N-]c3nc(C)c4c(n3)CCCC4=O)nc(C)c2c1	ZINC000072467920	203229343	/nfs/dbraw/zinc/22/93/43/203229343.db2.gz	MPUZFGCQAXFLKJ-UHFFFAOYSA-N	-1	0	333.395	3.608	10	0		EHAERM
O=C([O-])c1ccc(NC(=O)c2ccc(F)cc2Br)cc1	ZINC000013259746	207368632	/nfs/dbraw/zinc/36/86/32/207368632.db2.gz	FUDHRIYORVUZLI-UHFFFAOYSA-N	-1	0	338.132	3.539	10	0		EHAERM
CCOC(=O)CC(C(=O)c1ccc(C)cc1)=C([O-])c1ccc(C)cc1	ZINC000100483848	563982630	/nfs/dbraw/zinc/98/26/30/563982630.db2.gz	CCKCIGSYEVWQPL-UHFFFAOYSA-N	-1	0	338.403	3.938	10	0		EHAERM
O=C([O-])CN(Cc1csc(-c2ccccc2)n1)Cc1ccccc1	ZINC000692456890	976489495	/nfs/dbraw/zinc/48/94/95/976489495.db2.gz	VGXWLBXKJFNCHE-UHFFFAOYSA-N	-1	0	338.432	3.897	10	0		EHAERM
O=C([O-])[C@@H](c1ccccc1)N1Cc2ccc(Br)cc2C1	ZINC000707900233	977404296	/nfs/dbraw/zinc/40/42/96/977404296.db2.gz	VDRUPMWCBRWXFJ-OAHLLOKOSA-N	-1	0	332.197	3.591	10	0		EHAERM
COc1cc(Br)ccc1NCc1cc(C(=O)[O-])cs1	ZINC000712293268	977578832	/nfs/dbraw/zinc/57/88/32/977578832.db2.gz	ORXHLASOVMRLGK-UHFFFAOYSA-N	-1	0	342.214	3.830	10	0		EHAERM
O=C([O-])c1cc(CN2Cc3cccc(Br)c3C2)cs1	ZINC000713200620	977631195	/nfs/dbraw/zinc/63/11/95/977631195.db2.gz	RUZBIMUZKNGSTA-UHFFFAOYSA-N	-1	0	338.226	3.725	10	0		EHAERM
O=C([O-])c1sccc1CN1CCc2c1cccc2Br	ZINC000713309256	977633175	/nfs/dbraw/zinc/63/31/75/977633175.db2.gz	LGUITSZAXZCOQM-UHFFFAOYSA-N	-1	0	338.226	3.772	10	0		EHAERM
Cc1cc(C(=O)[O-])oc1C(=O)Nc1cc(C)cc(Br)c1	ZINC000717244008	977884204	/nfs/dbraw/zinc/88/42/04/977884204.db2.gz	FEIOOAWGGRMZIH-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
C[C@H]1OCCC[C@@H]1C(=O)Nc1cc(Br)cc(Cl)c1[O-]	ZINC000276649407	1022050362	/nfs/dbraw/zinc/05/03/62/1022050362.db2.gz	CVVPHJNTCQPJBV-APPZFPTMSA-N	-1	0	348.624	3.562	10	0		EHAERM
CC[C@@H](c1n[n-]c(=NC(=O)N2C[C@@H]3CCC[C@@H]32)s1)c1ccccc1	ZINC000329943905	1024261676	/nfs/dbraw/zinc/26/16/76/1024261676.db2.gz	WMPLBAJQFHMOIQ-ZNMIVQPWSA-N	-1	0	342.468	3.518	10	0		EHAERM
CCc1oc(C(=O)N2CC=C(c3cccc(C)c3)CC2)cc1C(=O)[O-]	ZINC000261696254	1029484648	/nfs/dbraw/zinc/48/46/48/1029484648.db2.gz	SJWUSDRZCNSMNQ-UHFFFAOYSA-N	-1	0	339.391	3.778	10	0		EHAERM
O=C([O-])[C@@H]1CCC[C@@H](C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)C1	ZINC000262759524	1029630884	/nfs/dbraw/zinc/63/08/84/1029630884.db2.gz	KOAGJBWLODCCEW-BECVJJOHSA-N	-1	0	327.424	3.582	10	0		EHAERM
O=C([O-])c1ccccc1OCc1ccc(F)c(Br)c1	ZINC000019476482	202009184	/nfs/dbraw/zinc/00/91/84/202009184.db2.gz	FPVZXURLHCBNDI-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
CC(C)Nc1c(Br)cc(Br)cc1C(=O)[O-]	ZINC000033494594	202263100	/nfs/dbraw/zinc/26/31/00/202263100.db2.gz	KIXNIHHJVHHJMH-UHFFFAOYSA-N	-1	0	337.011	3.730	10	0		EHAERM
CC(C)CCS(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1Cl	ZINC000037310420	202338815	/nfs/dbraw/zinc/33/88/15/202338815.db2.gz	PHYDKNIKGPJVLS-UHFFFAOYSA-N	-1	0	325.213	3.511	10	0		EHAERM
CCc1c(C)nc(Nc2cccc(Cl)c2C)nc1OCC(=O)[O-]	ZINC000073704188	202372158	/nfs/dbraw/zinc/37/21/58/202372158.db2.gz	UNFOXJWWRGCEJT-UHFFFAOYSA-N	-1	0	335.791	3.516	10	0		EHAERM
CCCc1cc(OCC(=O)[O-])nc(Nc2ccc(C)cc2Cl)n1	ZINC000073704423	202372367	/nfs/dbraw/zinc/37/23/67/202372367.db2.gz	FNTRNQGOKSEGRM-UHFFFAOYSA-N	-1	0	335.791	3.598	10	0		EHAERM
CN(Cc1cc(Br)cs1)c1ccc(C(=O)[O-])cc1	ZINC000042399735	202494774	/nfs/dbraw/zinc/49/47/74/202494774.db2.gz	IFXIPIFGGKGBGL-UHFFFAOYSA-N	-1	0	326.215	3.845	10	0		EHAERM
Cc1nc(-c2ccc(Nc3nc(CC(=O)[O-])cs3)cc2)cs1	ZINC000090694283	201373710	/nfs/dbraw/zinc/37/37/10/201373710.db2.gz	AJLMJAQJMSASMB-UHFFFAOYSA-N	-1	0	331.422	3.946	10	0		EHAERM
O=C([O-])c1cccc(Oc2ccc(Br)cc2Cl)n1	ZINC000051041599	202636564	/nfs/dbraw/zinc/63/65/64/202636564.db2.gz	MDZSOHPRQXONCX-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
CCC[C@@H](C)Oc1ccc(-c2cc(C)n3nc(C(=O)[O-])cc3n2)cc1	ZINC000002801333	201547102	/nfs/dbraw/zinc/54/71/02/201547102.db2.gz	HUJZZKBZGOKJFU-CYBMUJFWSA-N	-1	0	339.395	3.970	10	0		EHAERM
O=C([O-])c1nnn(-c2ccccc2C(F)(F)F)c1-c1ccccc1	ZINC000070456697	203077231	/nfs/dbraw/zinc/07/72/31/203077231.db2.gz	XBKZYWUUAIRJFV-UHFFFAOYSA-N	-1	0	333.269	3.651	10	0		EHAERM
Cc1ccc(F)cc1-n1nnc(C(=O)[O-])c1-c1ccc(Cl)cc1	ZINC000070456822	203077538	/nfs/dbraw/zinc/07/75/38/203077538.db2.gz	JMTJBCLGMHVDTG-UHFFFAOYSA-N	-1	0	331.734	3.733	10	0		EHAERM
O=C([O-])c1cc(F)ccc1NC(=O)c1ccc(Br)cc1	ZINC000019510025	212034972	/nfs/dbraw/zinc/03/49/72/212034972.db2.gz	NHZHWQZNYXWGCP-UHFFFAOYSA-N	-1	0	338.132	3.539	10	0		EHAERM
CC(C)(C)OC(=O)N[C@H](CCc1c(Cl)cccc1Cl)C(=O)[O-]	ZINC000095642259	203767323	/nfs/dbraw/zinc/76/73/23/203767323.db2.gz	ZKPXAFPZANUSHE-GFCCVEGCSA-N	-1	0	348.226	3.904	10	0		EHAERM
CC(C)(C)OC(=O)N[C@H](CCc1ccccc1C(F)(F)F)C(=O)[O-]	ZINC000095749155	203768284	/nfs/dbraw/zinc/76/82/84/203768284.db2.gz	SWWMIAKBHAXMBF-GFCCVEGCSA-N	-1	0	347.333	3.616	10	0		EHAERM
CC(C)CN(CC(C)C)c1ncc(Br)cc1C(=O)[O-]	ZINC000104179771	204098379	/nfs/dbraw/zinc/09/83/79/204098379.db2.gz	FKHWXEGDDIQWJE-UHFFFAOYSA-N	-1	0	329.238	3.661	10	0		EHAERM
CCC[C@@H]1CN(c2ccc(C(=O)[O-])cc2)CCN1C(=O)OC(C)(C)C	ZINC000039952679	132398255	/nfs/dbraw/zinc/39/82/55/132398255.db2.gz	FYDKKRBUSFSRED-MRXNPFEDSA-N	-1	0	348.443	3.611	10	0		EHAERM
C[C@@H]1CCC[C@@H](C[C@@H](CNC(=O)OCc2ccccc2)C(=O)[O-])C1	ZINC000725245194	563975912	/nfs/dbraw/zinc/97/59/12/563975912.db2.gz	BHGKNLZLPURLFA-OIISXLGYSA-N	-1	0	333.428	3.830	10	0		EHAERM
Cc1nc(-c2ccc(S(=O)(=O)[N-]c3cc(C(C)C)no3)cc2)co1	ZINC000075106760	564080112	/nfs/dbraw/zinc/08/01/12/564080112.db2.gz	ZNSNABWOLVSCID-UHFFFAOYSA-N	-1	0	347.396	3.562	10	0		EHAERM
O=C([O-])c1ccc(Cl)c2c1CN(C(=O)OCc1ccccc1)CC2	ZINC000669384148	564084496	/nfs/dbraw/zinc/08/44/96/564084496.db2.gz	OQPQRNYPCQIPBF-UHFFFAOYSA-N	-1	0	345.782	3.733	10	0		EHAERM
C[C@H]1C[C@H](NC(=O)OCc2ccccc2)c2c1c(F)ccc2C(=O)[O-]	ZINC000536959927	564091802	/nfs/dbraw/zinc/09/18/02/564091802.db2.gz	LWSAVCBZWQWLEV-NHYWBVRUSA-N	-1	0	343.354	3.999	10	0		EHAERM
O=C([O-])CCCCC(=O)Nc1cccc(Br)c1Cl	ZINC000690848095	954678108	/nfs/dbraw/zinc/67/81/08/954678108.db2.gz	CFHYFAOPZWIYRL-UHFFFAOYSA-N	-1	0	334.597	3.686	10	0		EHAERM
Cc1ccc(C(=O)[O-])cc1NC(=O)c1ccsc1Br	ZINC000698553216	976892372	/nfs/dbraw/zinc/89/23/72/976892372.db2.gz	TUZMBYAVUYKSKZ-UHFFFAOYSA-N	-1	0	340.198	3.770	10	0		EHAERM
CN(Cc1cc(C(=O)[O-])cs1)Cc1ccccc1Br	ZINC000711468878	977550191	/nfs/dbraw/zinc/55/01/91/977550191.db2.gz	MISANOUABPCGRB-UHFFFAOYSA-N	-1	0	340.242	3.841	10	0		EHAERM
COc1cc(Br)ccc1NCc1cc(C)c(C(=O)[O-])o1	ZINC000712286578	977579305	/nfs/dbraw/zinc/57/93/05/977579305.db2.gz	NIILACAYPCUCBW-UHFFFAOYSA-N	-1	0	340.173	3.669	10	0		EHAERM
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(Br)cc1C(=O)[O-]	ZINC000714402256	977671503	/nfs/dbraw/zinc/67/15/03/977671503.db2.gz	SOBZNDHYOCYILC-KOLCDFICSA-N	-1	0	340.217	3.912	10	0		EHAERM
O=C([O-])C1(c2csc(-c3sccc3Br)n2)CC1	ZINC000821930114	978927319	/nfs/dbraw/zinc/92/73/19/978927319.db2.gz	KXSQIPCCUPKXII-UHFFFAOYSA-N	-1	0	330.228	3.750	10	0		EHAERM
CC(C)[C@H](C)CC(=O)N[C@H](CC(=O)[O-])c1ccc(Cl)c(F)c1	ZINC000236632548	1024052437	/nfs/dbraw/zinc/05/24/37/1024052437.db2.gz	MSSXTTXIULXWLP-QMTHXVAHSA-N	-1	0	329.799	3.793	10	0		EHAERM
O=C([O-])[C@@H]1C[C@@H](c2ccccc2)CN(C(=O)c2ccc(Cl)s2)C1	ZINC000180333486	1031880529	/nfs/dbraw/zinc/88/05/29/1031880529.db2.gz	GIWVZGSIPKOSCV-CHWSQXEVSA-N	-1	0	349.839	3.732	10	0		EHAERM
O=C(c1ccc(Cl)cc1[O-])N1CC2(CCOCC2)c2ccccc21	ZINC000189783925	1036129211	/nfs/dbraw/zinc/12/92/11/1036129211.db2.gz	QBZLGSFIPNUDRY-UHFFFAOYSA-N	-1	0	343.810	3.754	10	0		EHAERM
CO[C@H](C)c1cccc(NS(=O)(=O)c2ccc3c(c2)C[C@H](C)O3)c1	ZINC000106007643	1037293027	/nfs/dbraw/zinc/29/30/27/1037293027.db2.gz	QTNNMTXEVQUGOY-QWHCGFSZSA-N	-1	0	347.436	3.518	10	0		EHAERM
CC(C)c1ccc(-c2csc3ncn([C@H](C)C(=O)[O-])c(=O)c23)cc1	ZINC000019955281	202028094	/nfs/dbraw/zinc/02/80/94/202028094.db2.gz	NXRLZDLRYYSOIN-LLVKDONJSA-N	-1	0	342.420	3.894	10	0		EHAERM
Cc1nn(-c2cccc(Br)c2)c2sc(C(=O)[O-])cc12	ZINC000035778769	202309703	/nfs/dbraw/zinc/30/97/03/202309703.db2.gz	FSBZILMYJUWFBZ-UHFFFAOYSA-N	-1	0	337.198	3.856	10	0		EHAERM
CCC(CC)(Cc1nc2cc(Br)ccc2[nH]1)C(=O)[O-]	ZINC000037441020	202342668	/nfs/dbraw/zinc/34/26/68/202342668.db2.gz	BMXIASZPOSZIQP-UHFFFAOYSA-N	-1	0	325.206	3.759	10	0		EHAERM
CCCCc1ccc(Nc2nc(C)c(CC)c(OCC(=O)[O-])n2)cc1	ZINC000073697888	202371888	/nfs/dbraw/zinc/37/18/88/202371888.db2.gz	RAKJNQSHFORBTR-UHFFFAOYSA-N	-1	0	343.427	3.897	10	0		EHAERM
O=C([O-])c1cccnc1SNCc1ccccc1C(F)(F)F	ZINC000057344782	201138893	/nfs/dbraw/zinc/13/88/93/201138893.db2.gz	LOUFSQYZGYXUPS-UHFFFAOYSA-N	-1	0	328.315	3.596	10	0		EHAERM
Cc1ccsc1C(=O)NC[C@H](CC(=O)[O-])c1ccc(Cl)cc1	ZINC000049474978	202623969	/nfs/dbraw/zinc/62/39/69/202623969.db2.gz	WQSGNBYTMSBXSR-LBPRGKRZSA-N	-1	0	337.828	3.698	10	0		EHAERM
Cc1nn(-c2ccc(F)cc2)c2c1-c1sc(C(=O)[O-])cc1CC2	ZINC000049454711	202622413	/nfs/dbraw/zinc/62/24/13/202622413.db2.gz	IWTXUNQRRPKGAS-UHFFFAOYSA-N	-1	0	328.368	3.845	10	0		EHAERM
O=C([O-])c1ccc(S(=O)(=O)c2ccc(Cl)cc2)cc1Cl	ZINC000053994420	202663850	/nfs/dbraw/zinc/66/38/50/202663850.db2.gz	LCVULNXSXCAANC-UHFFFAOYSA-N	-1	0	331.176	3.524	10	0		EHAERM
CC(C)c1cc(N2CCC[C@@H](C(=O)[O-])C2)nc(-c2ccccc2)n1	ZINC000070452300	203076957	/nfs/dbraw/zinc/07/69/57/203076957.db2.gz	LQOFZWYXPOUUHI-OAHLLOKOSA-N	-1	0	325.412	3.568	10	0		EHAERM
CCOc1ccc(-n2nnc(C(=O)[O-])c2-c2ccc(Cl)cc2)cc1	ZINC000070456827	203076578	/nfs/dbraw/zinc/07/65/78/203076578.db2.gz	FLTARJPATTUTGC-UHFFFAOYSA-N	-1	0	343.770	3.685	10	0		EHAERM
CCc1c(C)nc(-c2ccc(F)cc2)nc1N1CCCC[C@H]1C(=O)[O-]	ZINC000070452248	203076882	/nfs/dbraw/zinc/07/68/82/203076882.db2.gz	FSTDDZQVZYLEHU-INIZCTEOSA-N	-1	0	343.402	3.597	10	0		EHAERM
O=C([O-])c1cc(Br)cnc1Nc1cc(F)ccc1F	ZINC000104179749	204097880	/nfs/dbraw/zinc/09/78/80/204097880.db2.gz	BOQDJFQWOJBBNT-UHFFFAOYSA-N	-1	0	329.100	3.564	10	0		EHAERM
O=C([O-])c1sccc1C[S@](=O)c1ccccc1Br	ZINC000104343787	204106070	/nfs/dbraw/zinc/10/60/70/204106070.db2.gz	NKTYFRFRXUZLSK-GOSISDBHSA-N	-1	0	345.239	3.517	10	0		EHAERM
Cc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C(=O)[O-])c(Cl)c1	ZINC000409422236	563962030	/nfs/dbraw/zinc/96/20/30/563962030.db2.gz	CWCVWYQXUQWCRI-OLZOCXBDSA-N	-1	0	339.819	3.684	10	0		EHAERM
CC1CCN(c2ccc(NC(=O)C3CCCC3)c(C(=O)[O-])c2)CC1	ZINC000064589242	564092567	/nfs/dbraw/zinc/09/25/67/564092567.db2.gz	HMJYHPXXYXRUHW-UHFFFAOYSA-N	-1	0	330.428	3.750	10	0		EHAERM
O=C([O-])c1ccc(Br)c(NC(=O)[C@]23C[C@H]2CCCC3)c1	ZINC000693240610	954730048	/nfs/dbraw/zinc/73/00/48/954730048.db2.gz	FCQQLDIPENLGIS-MEBBXXQBSA-N	-1	0	338.201	3.666	10	0		EHAERM
Cc1ccc(C(=O)Nc2cccc(Br)c2)cc1C(=O)[O-]	ZINC000716472796	977844012	/nfs/dbraw/zinc/84/40/12/977844012.db2.gz	TXVBZROFBFWXAV-UHFFFAOYSA-N	-1	0	334.169	3.708	10	0		EHAERM
Cc1cc(C(=O)[O-])oc1C(=O)Nc1ccc(C)c(Br)c1	ZINC000717244837	977883989	/nfs/dbraw/zinc/88/39/89/977883989.db2.gz	IOLYDPUXGFTBTO-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
C[C@@H](NC(=O)C1CCC(C(=O)[O-])CC1)c1nc(C(C)(C)C)cs1	ZINC000194412245	1024412004	/nfs/dbraw/zinc/41/20/04/1024412004.db2.gz	VCIKICSOSHDPFJ-VOMCLLRMSA-N	-1	0	338.473	3.509	10	0		EHAERM
O=C([O-])[C@H]1C[C@@H](c2ccccc2)CN(C(=O)c2cc3ccccc3o2)C1	ZINC000180308946	1031878052	/nfs/dbraw/zinc/87/80/52/1031878052.db2.gz	RUXKOGIQHQEHRA-SJORKVTESA-N	-1	0	349.386	3.763	10	0		EHAERM
CN1Cc2cc(NC(=O)Nc3ccc(O)c(Cl)c3)ccc2NC1=O	ZINC000192272688	1036490347	/nfs/dbraw/zinc/49/03/47/1036490347.db2.gz	UROMQTQQJNIAEH-UHFFFAOYSA-N	-1	0	346.774	3.667	10	0		EHAERM
O=C([O-])c1cnc(Oc2ccc(Br)cc2)c(Cl)c1	ZINC000019513325	202010508	/nfs/dbraw/zinc/01/05/08/202010508.db2.gz	TTZOJWFITZMSKR-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
C[C@@H]1CCc2c(sc(NC(=O)c3ccccc3F)c2C(=O)[O-])C1	ZINC000020333608	202039508	/nfs/dbraw/zinc/03/95/08/202039508.db2.gz	JTXIFICUYCZHBU-SECBINFHSA-N	-1	0	333.384	3.963	10	0		EHAERM
C[C@H]1CCc2c(sc(NC(=O)Cc3ccc(F)cc3)c2C(=O)[O-])C1	ZINC000020333692	202039520	/nfs/dbraw/zinc/03/95/20/202039520.db2.gz	STBHLCVHZMHTRA-JTQLQIEISA-N	-1	0	347.411	3.891	10	0		EHAERM
Cc1nn(C)c(Oc2ccc(Cl)cc2Br)c1C(=O)[O-]	ZINC000020446603	202042622	/nfs/dbraw/zinc/04/26/22/202042622.db2.gz	UADRQSLJRORZLC-UHFFFAOYSA-N	-1	0	345.580	3.635	10	0		EHAERM
O=C(Nc1ccccc1Cl)c1c[n-]c2cc(F)cc(F)c2c1=O	ZINC000032608081	202228333	/nfs/dbraw/zinc/22/83/33/202228333.db2.gz	UKYBDLZASHLYRQ-UHFFFAOYSA-N	-1	0	334.709	3.712	10	0		EHAERM
Cc1nc(Nc2ccc(Br)cc2C)sc1C(=O)[O-]	ZINC000033507794	202262550	/nfs/dbraw/zinc/26/25/50/202262550.db2.gz	FVNVQHDCFJEFOI-UHFFFAOYSA-N	-1	0	327.203	3.964	10	0		EHAERM
CCc1c(C)nc(Nc2ccc(C(C)C)cc2)nc1OCC(=O)[O-]	ZINC000073697815	202371785	/nfs/dbraw/zinc/37/17/85/202371785.db2.gz	KNHNIVGDWBXRFV-UHFFFAOYSA-N	-1	0	329.400	3.678	10	0		EHAERM
O=C([O-])CSc1cc(-c2ccncc2)nc(-c2cccc(F)c2)n1	ZINC000073695551	202372409	/nfs/dbraw/zinc/37/24/09/202372409.db2.gz	NAQBNBVPJSLSCR-UHFFFAOYSA-N	-1	0	341.367	3.521	10	0		EHAERM
Cc1cccc(Nc2nc(OCC(=O)[O-])cc(C(C)(C)C)n2)c1C	ZINC000073697068	202372456	/nfs/dbraw/zinc/37/24/56/202372456.db2.gz	FCWJXAGBQSGRNV-UHFFFAOYSA-N	-1	0	329.400	3.598	10	0		EHAERM
CCc1c(C)nc(-c2ccc(C)cc2)nc1N1CCCC[C@H]1C(=O)[O-]	ZINC000070452152	203075051	/nfs/dbraw/zinc/07/50/51/203075051.db2.gz	POUSOKLAENXLLL-KRWDZBQOSA-N	-1	0	339.439	3.766	10	0		EHAERM
CCCc1cc(-n2ccc(C(=O)[O-])n2)nc(-c2cccc(Cl)c2)n1	ZINC000070452640	203076988	/nfs/dbraw/zinc/07/69/88/203076988.db2.gz	UPHUNCDLGCXLOG-UHFFFAOYSA-N	-1	0	342.786	3.633	10	0		EHAERM
CCCc1cc(N2CCC[C@@H](C(=O)[O-])C2)nc(-c2cccc(F)c2)n1	ZINC000070452326	203077493	/nfs/dbraw/zinc/07/74/93/203077493.db2.gz	CGLSDRFNQARYHV-CQSZACIVSA-N	-1	0	343.402	3.536	10	0		EHAERM
CN(c1nc(C2CC2)nc(C(=O)[O-])c1Cl)[C@@H]1C[C@@H]1c1ccccc1	ZINC000098180835	203987561	/nfs/dbraw/zinc/98/75/61/203987561.db2.gz	QBDAVKZSHUQVRX-CHWSQXEVSA-N	-1	0	343.814	3.698	10	0		EHAERM
O=C([O-])c1ccc(C[S@@](=O)c2ccc(Br)cc2)s1	ZINC000103918669	204089945	/nfs/dbraw/zinc/08/99/45/204089945.db2.gz	APNUMRBHQWHVCB-SFHVURJKSA-N	-1	0	345.239	3.517	10	0		EHAERM
CC1=C[C@H](C)C[C@@H](C[C@H](CNC(=O)OCc2ccccc2)C(=O)[O-])C1	ZINC000725246650	563976124	/nfs/dbraw/zinc/97/61/24/563976124.db2.gz	RRPQTOJEWJMDFK-BMGDILEWSA-N	-1	0	345.439	3.996	10	0		EHAERM
CCCOc1nc2c(C)cc(Br)c(F)c2cc1C(=O)[O-]	ZINC000675051927	564052397	/nfs/dbraw/zinc/05/23/97/564052397.db2.gz	XVWOBNDFOBOPBL-UHFFFAOYSA-N	-1	0	342.164	3.932	10	0		EHAERM
Cc1cc(C(=O)[O-])nc2cc(Br)c(Br)cc12	ZINC000669372239	564084060	/nfs/dbraw/zinc/08/40/60/564084060.db2.gz	JNURAFVIVBBZMH-UHFFFAOYSA-N	-1	0	344.990	3.766	10	0		EHAERM
C[C@@H](c1ccc(C(=O)[O-])o1)N1CCc2ccc(Br)cc21	ZINC000713325862	977633016	/nfs/dbraw/zinc/63/30/16/977633016.db2.gz	WHZCZGINJXSHQK-VIFPVBQESA-N	-1	0	336.185	3.864	10	0		EHAERM
O=C([N-]S(=O)(=O)c1ccc2ccccc2c1)[C@H]1CC12CCCCC2	ZINC000408479815	1019562409	/nfs/dbraw/zinc/56/24/09/1019562409.db2.gz	NEKPLEVQMBMZBW-QGZVFWFLSA-N	-1	0	343.448	3.615	10	0		EHAERM
O=S(=O)(/C=C\c1ccc(F)cc1)[N-]c1cnoc1-c1ccccc1	ZINC000588388659	1020023102	/nfs/dbraw/zinc/02/31/02/1020023102.db2.gz	CQCIEHONPIKYLV-KHPPLWFESA-N	-1	0	344.367	3.893	10	0		EHAERM
Cc1nc([C@@H]2CCCN2C(=O)c2cc(F)cc(Cl)c2[O-])cs1	ZINC000189251931	1140330294	/nfs/dbraw/zinc/33/02/94/1140330294.db2.gz	MEFHGIRNLXSIER-ZDUSSCGKSA-N	-1	0	340.807	3.927	10	0		EHAERM
CCc1cccc(CC)c1NC(=O)c1ccc(O[C@H](C)C(=O)[O-])cc1	ZINC000004226173	210146195	/nfs/dbraw/zinc/14/61/95/210146195.db2.gz	YZBPNHCNTNGWJE-CYBMUJFWSA-N	-1	0	341.407	3.916	10	0		EHAERM
COc1ccc([C@@H](Nc2ccccc2)C(=O)[O-])cc1Br	ZINC000038052402	213198397	/nfs/dbraw/zinc/19/83/97/213198397.db2.gz	SFPNAKKMODPUIQ-CQSZACIVSA-N	-1	0	336.185	3.696	10	0		EHAERM
O=C([O-])[C@@H](Cc1cccs1)Cc1ccc(Br)cc1	ZINC000037528382	213154611	/nfs/dbraw/zinc/15/46/11/213154611.db2.gz	ZYFUDNIVSKJANQ-LLVKDONJSA-N	-1	0	325.227	3.997	10	0		EHAERM
CCn1c(CCCCC(=O)[O-])nc2cc(Br)ccc21	ZINC000037441066	213146629	/nfs/dbraw/zinc/14/66/29/213146629.db2.gz	VYIBIAXJVNRLOW-UHFFFAOYSA-N	-1	0	325.206	3.616	10	0		EHAERM
CCCCc1ccc(Nc2nc(CC)c(C)c(OCC(=O)[O-])n2)cc1	ZINC000073697891	216412937	/nfs/dbraw/zinc/41/29/37/216412937.db2.gz	VBMWJSHKLCVLBG-UHFFFAOYSA-N	-1	0	343.427	3.897	10	0		EHAERM
Cc1ccc(Nc2nc(OCC(=O)[O-])cc(C(C)(C)C)n2)cc1Cl	ZINC000073704269	216415389	/nfs/dbraw/zinc/41/53/89/216415389.db2.gz	YSUVVJLIKXZBJN-UHFFFAOYSA-N	-1	0	349.818	3.943	10	0		EHAERM
COc1cccc2c1c(CC(=O)[O-])cn2C(=O)c1ccc(Cl)cc1	ZINC000204606235	241041470	/nfs/dbraw/zinc/04/14/70/241041470.db2.gz	SFHMJTAZSHYOJP-UHFFFAOYSA-N	-1	0	343.766	3.619	10	0		EHAERM
Cc1sc(NC(=O)[C@@H]2CCCO2)c(C(=O)[O-])c1-c1ccc(C)cc1	ZINC000020334530	212120656	/nfs/dbraw/zinc/12/06/56/212120656.db2.gz	FVQJXYXIEXLABB-ZDUSSCGKSA-N	-1	0	345.420	3.848	10	0		EHAERM
COc1ccc(C(=O)Nc2sc3c(c2C(=O)[O-])CC[C@@H](C)C3)cc1	ZINC000020333636	212120356	/nfs/dbraw/zinc/12/03/56/212120356.db2.gz	VKUBTRATEGNOHF-SNVBAGLBSA-N	-1	0	345.420	3.832	10	0		EHAERM
O=C([O-])c1csc(C(=O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000008029175	210885423	/nfs/dbraw/zinc/88/54/23/210885423.db2.gz	COJFOPSDRJDDBJ-UHFFFAOYSA-N	-1	0	339.372	3.770	10	0		EHAERM
CC(C)(C)OC(=O)NC[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[O-]	ZINC000095750549	218447683	/nfs/dbraw/zinc/44/76/83/218447683.db2.gz	SVPWGHUSSPARJA-SNVBAGLBSA-N	-1	0	348.226	3.761	10	0		EHAERM
O=C([O-])CC1(NC(=O)OCC2c3ccccc3-c3ccccc32)CC1	ZINC000307280361	563933035	/nfs/dbraw/zinc/93/30/35/563933035.db2.gz	YWVNZDQHPYFHGS-UHFFFAOYSA-N	-1	0	337.375	3.532	10	0		EHAERM
CCCOc1nc2c(F)cc(Br)cc2cc1C(=O)[O-]	ZINC000675051956	564052395	/nfs/dbraw/zinc/05/23/95/564052395.db2.gz	YMEQGGCWWIIEFJ-UHFFFAOYSA-N	-1	0	328.137	3.623	10	0		EHAERM
O=[S@]([O-])c1ccc(Oc2ccc(F)c(Br)c2)cc1	ZINC000675062320	564112373	/nfs/dbraw/zinc/11/23/73/564112373.db2.gz	PRUWMOMLWBQTBZ-UHFFFAOYSA-N	-1	0	331.162	3.961	10	0		EHAERM
O=C([O-])C1(C(=O)Nc2cccc(Cl)c2Cl)CCSCC1	ZINC000707399641	954968547	/nfs/dbraw/zinc/96/85/47/954968547.db2.gz	JRMOAHIZUCQYEC-UHFFFAOYSA-N	-1	0	334.224	3.530	10	0		EHAERM
CCN(C(=O)Nc1ccccc1OCc1ccccc1)[C@@H](C)C(=O)[O-]	ZINC000707948866	954986095	/nfs/dbraw/zinc/98/60/95/954986095.db2.gz	NEBSXSPFYXXNBY-AWEZNQCLSA-N	-1	0	342.395	3.593	10	0		EHAERM
O=C([O-])CCN(Cc1cc(-c2cccs2)on1)Cc1ccccc1	ZINC000692492105	976509491	/nfs/dbraw/zinc/50/94/91/976509491.db2.gz	ATJQGBPUNVNTJT-UHFFFAOYSA-N	-1	0	342.420	3.880	10	0		EHAERM
Cc1cc(Br)c(Cl)cc1NC(=O)CCCC(=O)[O-]	ZINC000698079676	976876861	/nfs/dbraw/zinc/87/68/61/976876861.db2.gz	SFOVHFYVMSUVTP-UHFFFAOYSA-N	-1	0	334.597	3.604	10	0		EHAERM
CC(C)(CSc1nc2cc(Br)ccc2o1)C(=O)[O-]	ZINC000700325023	976946596	/nfs/dbraw/zinc/94/65/96/976946596.db2.gz	BAEMRWAZTLGMPI-UHFFFAOYSA-N	-1	0	330.203	3.793	10	0		EHAERM
O=C([O-])c1sc(Sc2nc3cnccc3s2)nc1Cl	ZINC000702968152	977137156	/nfs/dbraw/zinc/13/71/56/977137156.db2.gz	PETICPBCFCJSHK-UHFFFAOYSA-N	-1	0	329.815	3.651	10	0		EHAERM
CC(C)C[C@@H](C)C(=O)Nc1ccc(Br)cc1C(=O)[O-]	ZINC000704611707	977240303	/nfs/dbraw/zinc/24/03/03/977240303.db2.gz	PZABICZJFOOCHE-SECBINFHSA-N	-1	0	328.206	3.768	10	0		EHAERM
CC(C)C[C@@H](C)C(=O)Nc1ccc(Br)c(C(=O)[O-])c1	ZINC000704611910	977240385	/nfs/dbraw/zinc/24/03/85/977240385.db2.gz	QLTNRMOBTNKOLL-SECBINFHSA-N	-1	0	328.206	3.768	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1NC(=O)[C@@H]1CCCC12CC2	ZINC000706259409	977311526	/nfs/dbraw/zinc/31/15/26/977311526.db2.gz	NXDBYWMINBUDDE-NSHDSACASA-N	-1	0	338.201	3.666	10	0		EHAERM
Cc1cc(C(=O)[O-])oc1C(=O)N(Cc1ccccc1)[C@H](C)C1CC1	ZINC000717209692	977877969	/nfs/dbraw/zinc/87/79/69/977877969.db2.gz	QFGBPTJDXTYOTA-CYBMUJFWSA-N	-1	0	327.380	3.727	10	0		EHAERM
CN(Cc1csc(C(=O)[O-])c1)c1ccc(Br)cc1	ZINC000723906620	978220462	/nfs/dbraw/zinc/22/04/62/978220462.db2.gz	LKZGXZIEWHDSLB-UHFFFAOYSA-N	-1	0	326.215	3.845	10	0		EHAERM
CC(=O)c1ccc(F)cc1[N-]S(=O)(=O)C=Cc1ccc(F)cc1	ZINC000588426006	1021562307	/nfs/dbraw/zinc/56/23/07/1021562307.db2.gz	PYXLEZVBIRNRPK-HJWRWDBZSA-N	-1	0	337.347	3.580	10	0		EHAERM
Cc1ccc(C(=O)[O-])c(N(C)Cc2cc(Br)cs2)n1	ZINC000054535201	214244278	/nfs/dbraw/zinc/24/42/78/214244278.db2.gz	UYZJBLVJBLKUED-UHFFFAOYSA-N	-1	0	341.230	3.549	10	0		EHAERM
O=C(C=C([O-])c1ccc(F)cc1)c1cc(Br)ccc1O	ZINC000100754706	219105940	/nfs/dbraw/zinc/10/59/40/219105940.db2.gz	PKKWRMTTZPFFKR-UHFFFAOYSA-N	-1	0	337.144	3.750	10	0		EHAERM
Cc1cc(C(=O)[O-])c(NC(=O)c2ccc(Br)s2)s1	ZINC000104353104	219377472	/nfs/dbraw/zinc/37/74/72/219377472.db2.gz	ZSAZIUXYOZUBJX-UHFFFAOYSA-N	-1	0	346.227	3.831	10	0		EHAERM
O=C([O-])c1ccc(Nc2c(-c3ccc(O)cc3)nc3cnccn32)cc1	ZINC000035476604	213031266	/nfs/dbraw/zinc/03/12/66/213031266.db2.gz	VZMWJGUNADEASQ-UHFFFAOYSA-N	-1	0	346.346	3.544	10	0		EHAERM
CCCn1cc(C(=O)[O-])c(=O)c2cc(Cl)c(C(F)(F)F)cc21	ZINC000072237320	216076159	/nfs/dbraw/zinc/07/61/59/216076159.db2.gz	HREPDCQNDRJMCZ-UHFFFAOYSA-N	-1	0	333.693	3.782	10	0		EHAERM
Cc1ccc(Cl)cc1Nc1nc(OCC(=O)[O-])cc(C(C)C)n1	ZINC000073704337	216415345	/nfs/dbraw/zinc/41/53/45/216415345.db2.gz	CRODSQAVBJJASK-UHFFFAOYSA-N	-1	0	335.791	3.769	10	0		EHAERM
Cc1sc2nc(C)nc(Nc3ccc(C(=O)[O-])c(O)c3)c2c1C	ZINC000020326664	212119653	/nfs/dbraw/zinc/11/96/53/212119653.db2.gz	FIPRCJVQHWFRAB-UHFFFAOYSA-N	-1	0	329.381	3.764	10	0		EHAERM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)c1ccc(OC(F)(F)F)c(F)c1	ZINC000504110181	257725020	/nfs/dbraw/zinc/72/50/20/257725020.db2.gz	GELGAGCZQMFRID-UWVGGRQHSA-N	-1	0	334.265	3.798	10	0		EHAERM
C[C@@H]1CCC[C@@H](C[C@H](CNC(=O)OCc2ccccc2)C(=O)[O-])C1	ZINC000725245192	563975934	/nfs/dbraw/zinc/97/59/34/563975934.db2.gz	BHGKNLZLPURLFA-DJIMGWMZSA-N	-1	0	333.428	3.830	10	0		EHAERM
C[C@H]1CC(C)(C)C[C@](CNC(=O)OCc2ccccc2)(C(=O)[O-])C1	ZINC000725245536	563976028	/nfs/dbraw/zinc/97/60/28/563976028.db2.gz	VGDWOUHBBFESSO-IFXJQAMLSA-N	-1	0	333.428	3.830	10	0		EHAERM
CC1(C)CCc2c([O-])cc3occ(-c4ccc(O)cc4)c(=O)c3c2O1	ZINC000096023777	563977900	/nfs/dbraw/zinc/97/79/00/563977900.db2.gz	DXGNQQLBHOTANA-UHFFFAOYSA-N	-1	0	338.359	3.975	10	0	biogenic	EHAERM
O=C([O-])C[C@@H]1CCN(C(=O)OCc2ccccc2)c2ccccc21	ZINC000675073124	564112783	/nfs/dbraw/zinc/11/27/83/564112783.db2.gz	RIXWWRJVHCASSS-HNNXBMFYSA-N	-1	0	325.364	3.792	10	0		EHAERM
Cc1oc(CN2Cc3ccc(Br)cc3C2)cc1C(=O)[O-]	ZINC000707905887	977403826	/nfs/dbraw/zinc/40/38/26/977403826.db2.gz	MPOZONQDXFIHHR-UHFFFAOYSA-N	-1	0	336.185	3.565	10	0		EHAERM
O=C([O-])c1csc(CN2CCc3cc(Br)ccc32)c1	ZINC000713345433	977634146	/nfs/dbraw/zinc/63/41/46/977634146.db2.gz	CTQCXXDDGRYNFI-UHFFFAOYSA-N	-1	0	338.226	3.772	10	0		EHAERM
C[C@@H]1C[C@@H](C(=O)[N-]S(=O)(=O)c2sccc2Cl)CC(C)(C)C1	ZINC000408497767	1019659883	/nfs/dbraw/zinc/65/98/83/1019659883.db2.gz	MDACOPGREFBGPJ-NXEZZACHSA-N	-1	0	349.905	3.669	10	0		EHAERM
O=C([O-])[C@@H]1C[C@H](c2ccccc2)CN(C(=O)c2ccc(Cl)s2)C1	ZINC000180333499	1031881158	/nfs/dbraw/zinc/88/11/58/1031881158.db2.gz	GIWVZGSIPKOSCV-QWHCGFSZSA-N	-1	0	349.839	3.732	10	0		EHAERM
Cc1nn(-c2cccc(F)c2)c2c1-c1sc(C(=O)[O-])cc1CC2	ZINC000049454719	214009487	/nfs/dbraw/zinc/00/94/87/214009487.db2.gz	WSALRFFAZIETMM-UHFFFAOYSA-N	-1	0	328.368	3.845	10	0		EHAERM
COc1ccc(Br)cc1COc1ccsc1C(=O)[O-]	ZINC000104070907	219344669	/nfs/dbraw/zinc/34/46/69/219344669.db2.gz	IXANQCYLLQESGQ-UHFFFAOYSA-N	-1	0	343.198	3.796	10	0		EHAERM
O=C([O-])c1nnn(-c2ccc(OC(F)(F)F)cc2)c1-c1ccccc1	ZINC000070456701	215694286	/nfs/dbraw/zinc/69/42/86/215694286.db2.gz	LLFHWSZJQCWSNH-UHFFFAOYSA-N	-1	0	349.268	3.531	10	0		EHAERM
CSc1cccc(-n2nnc(C(=O)[O-])c2-c2cccc(C)c2)c1	ZINC000070456887	215694582	/nfs/dbraw/zinc/69/45/82/215694582.db2.gz	JADFOTPHANTZST-UHFFFAOYSA-N	-1	0	325.393	3.663	10	0		EHAERM
O=C([O-])c1cn(Cc2ccc(F)cc2Cl)c2ccccc2c1=O	ZINC000070460663	215696787	/nfs/dbraw/zinc/69/67/87/215696787.db2.gz	RRZAGAVLLVLINT-UHFFFAOYSA-N	-1	0	331.730	3.541	10	0		EHAERM
O=C([O-])CCCc1nnc(-c2ccc(Br)cc2Cl)o1	ZINC000037729456	213163848	/nfs/dbraw/zinc/16/38/48/213163848.db2.gz	JANMVQLIOZYNPO-UHFFFAOYSA-N	-1	0	345.580	3.560	10	0		EHAERM
CN(CCC(=O)[O-])c1ncnc2sc3c(c21)CC[C@@H](C(C)(C)C)C3	ZINC000020317961	212118577	/nfs/dbraw/zinc/11/85/77/212118577.db2.gz	WJEPFJXCVNSCCU-LLVKDONJSA-N	-1	0	347.484	3.753	10	0		EHAERM
O=C([O-])Cc1ccc(OCc2ccc(F)c(Br)c2)cc1	ZINC000019843621	212075369	/nfs/dbraw/zinc/07/53/69/212075369.db2.gz	ASWCFQRXAGCCKU-UHFFFAOYSA-N	-1	0	339.160	3.794	10	0		EHAERM
O=C([O-])c1ccc(Oc2ccc(Cl)cc2Br)nc1	ZINC000019488130	212031960	/nfs/dbraw/zinc/03/19/60/212031960.db2.gz	FRGZSOKGZSZLNI-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
O=C([O-])c1cccc(OCc2ccc(F)cc2Br)c1	ZINC000013419470	211556401	/nfs/dbraw/zinc/55/64/01/211556401.db2.gz	QGRYKCJYCSPFQM-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
O=C([O-])C1CCN(c2ccc(Sc3ccc(Cl)cc3)nn2)CC1	ZINC000073665955	135619564	/nfs/dbraw/zinc/61/95/64/135619564.db2.gz	JUUPZSQDNKKPNY-UHFFFAOYSA-N	-1	0	349.843	3.582	10	0		EHAERM
CC(C)(C)OC(=O)N[C@H](CCc1cccc(C(F)(F)F)c1)C(=O)[O-]	ZINC000095749161	563977675	/nfs/dbraw/zinc/97/76/75/563977675.db2.gz	AILCRXQIDUAVMW-GFCCVEGCSA-N	-1	0	347.333	3.616	10	0		EHAERM
Cc1sc(-c2cc(N)c(C(=O)[O-])c(F)c2)cc1Br	ZINC000675050995	564111784	/nfs/dbraw/zinc/11/17/84/564111784.db2.gz	GAFOYOTWAIXJBU-UHFFFAOYSA-N	-1	0	330.178	3.906	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1NC(=O)[C@H]1CCCC12CC2	ZINC000706259405	977311664	/nfs/dbraw/zinc/31/16/64/977311664.db2.gz	NXDBYWMINBUDDE-LLVKDONJSA-N	-1	0	338.201	3.666	10	0		EHAERM
O=C([O-])c1cc(Br)cc(Oc2cc(C3CC3)ncn2)c1	ZINC000710103450	977481252	/nfs/dbraw/zinc/48/12/52/977481252.db2.gz	QFHYLDKTCPHVKQ-UHFFFAOYSA-N	-1	0	335.157	3.607	10	0		EHAERM
CC1(C)CCC[C@@H](COc2cc(Br)cc(C(=O)[O-])c2)O1	ZINC000714381032	977669654	/nfs/dbraw/zinc/66/96/54/977669654.db2.gz	KRJAMWLAKXPSKE-LBPRGKRZSA-N	-1	0	343.217	3.874	10	0		EHAERM
Cc1ccc(C(=O)Nc2ccc(Br)cc2)cc1C(=O)[O-]	ZINC000716470830	977843626	/nfs/dbraw/zinc/84/36/26/977843626.db2.gz	CTPHJMQHBIOPLC-UHFFFAOYSA-N	-1	0	334.169	3.708	10	0		EHAERM
O=C([O-])[C@H]1C[C@H](c2ccccc2)CN(C(=O)c2cc3ccccc3o2)C1	ZINC000180308963	1031878295	/nfs/dbraw/zinc/87/82/95/1031878295.db2.gz	RUXKOGIQHQEHRA-IRXDYDNUSA-N	-1	0	349.386	3.763	10	0		EHAERM
O=C([O-])[C@H](NCc1cccs1)c1ccc(Br)cc1F	ZINC000037966667	213176226	/nfs/dbraw/zinc/17/62/26/213176226.db2.gz	PLJVUOHEUCZUTB-GFCCVEGCSA-N	-1	0	344.205	3.565	10	0		EHAERM
O=C([O-])CN(Cc1ccc(Br)s1)c1ccccc1	ZINC000037595508	213160355	/nfs/dbraw/zinc/16/03/55/213160355.db2.gz	LLXAHBKZDUTNBS-UHFFFAOYSA-N	-1	0	326.215	3.602	10	0		EHAERM
O=C([O-])[C@H](Cc1ccccc1)Sc1ccc(Br)cn1	ZINC000037528129	213154346	/nfs/dbraw/zinc/15/43/46/213154346.db2.gz	DLIVFRNCQYXXLQ-LBPRGKRZSA-N	-1	0	338.226	3.632	10	0		EHAERM
Cc1cc([N-]S(=O)(=O)c2cc(Cl)sc2Cl)ccc1N	ZINC000036288841	213082411	/nfs/dbraw/zinc/08/24/11/213082411.db2.gz	WFSDROYYJUPCJG-UHFFFAOYSA-N	-1	0	337.253	3.746	10	0		EHAERM
Cc1cc(NC(=O)c2ccc(Br)s2)sc1C(=O)[O-]	ZINC000019282182	212010290	/nfs/dbraw/zinc/01/02/90/212010290.db2.gz	GBDLUSHFCULTRX-UHFFFAOYSA-N	-1	0	346.227	3.831	10	0		EHAERM
CC(C)(C)OC(=O)N1CCC[C@@H](/C(=C/C(=O)[O-])c2ccccc2)C1	ZINC000095920261	518804691	/nfs/dbraw/zinc/80/46/91/518804691.db2.gz	LYYFWDYFWTZOCK-XYGUXCPDSA-N	-1	0	331.412	3.802	10	0		EHAERM
O=C([O-])c1c(I)sc2c1CCCCCC2	ZINC000725245102	563975907	/nfs/dbraw/zinc/97/59/07/563975907.db2.gz	ACKNDSHJDUFIPV-UHFFFAOYSA-N	-1	0	336.194	3.710	10	0		EHAERM
O=[S@]([O-])c1ccc(Oc2cc(F)ccc2Br)cc1	ZINC000675062201	564112357	/nfs/dbraw/zinc/11/23/57/564112357.db2.gz	LBVWGDKCGMZRSX-UHFFFAOYSA-N	-1	0	331.162	3.961	10	0		EHAERM
O=C([O-])c1csc(CN2Cc3ccc(Br)cc3C2)c1	ZINC000707915636	977403982	/nfs/dbraw/zinc/40/39/82/977403982.db2.gz	HYPKGRYVAFRTBU-UHFFFAOYSA-N	-1	0	338.226	3.725	10	0		EHAERM
COc1cc(C(=O)[O-])ccc1OC[C@@H](C)COCc1ccccc1	ZINC000719418823	978002735	/nfs/dbraw/zinc/00/27/35/978002735.db2.gz	ICJQCGBVBIRSCE-AWEZNQCLSA-N	-1	0	330.380	3.625	10	0		EHAERM
Cc1c(Br)cncc1NCc1ccsc1C(=O)[O-]	ZINC000722722090	978165213	/nfs/dbraw/zinc/16/52/13/978165213.db2.gz	KGMCJPMKNDPGER-UHFFFAOYSA-N	-1	0	327.203	3.524	10	0		EHAERM
O=C([O-])[C@H]1C[C@H](c2ccccc2)CN(C(=O)c2ccc(Cl)s2)C1	ZINC000180333468	1031881252	/nfs/dbraw/zinc/88/12/52/1031881252.db2.gz	GIWVZGSIPKOSCV-STQMWFEESA-N	-1	0	349.839	3.732	10	0		EHAERM
O=C(C=C([O-])c1cc2cc(Br)ccc2o1)C(F)(F)F	ZINC000100720196	219104787	/nfs/dbraw/zinc/10/47/87/219104787.db2.gz	FUNQSNZHNJKJAK-UHFFFAOYSA-N	-1	0	335.075	3.900	10	0		EHAERM
Cc1ccc(Cn2nnc(C(=O)[O-])c2-c2ccc(Cl)cc2)cc1	ZINC000070457092	215695788	/nfs/dbraw/zinc/69/57/88/215695788.db2.gz	KBPPOYWKKPKNQV-UHFFFAOYSA-N	-1	0	327.771	3.653	10	0		EHAERM
O=C([O-])[C@H]1CCCN(C(=O)/C(=C\c2ccccc2)c2ccccc2)C1	ZINC000020200238	212111093	/nfs/dbraw/zinc/11/10/93/212111093.db2.gz	QYLWHVNLKOVGPF-OWBBTNHHSA-N	-1	0	335.403	3.550	10	0		EHAERM
O=C([O-])c1ccccc1OCc1cc(Br)ccc1F	ZINC000019480923	212030670	/nfs/dbraw/zinc/03/06/70/212030670.db2.gz	FGDVELLDFDOMRW-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
CCC[C@H](C)Oc1ccc(-c2cc(C)n3nc(C(=O)[O-])cc3n2)cc1	ZINC000002801334	563451131	/nfs/dbraw/zinc/45/11/31/563451131.db2.gz	HUJZZKBZGOKJFU-ZDUSSCGKSA-N	-1	0	339.395	3.970	10	0		EHAERM
COc1ccc2c(c1)[C@H]1OCC[C@H]1[C@H](c1ccc(C(=O)[O-])cc1)N2	ZINC000015017334	563772972	/nfs/dbraw/zinc/77/29/72/563772972.db2.gz	GVSGKIRRJYBZAJ-WBAXXEDZSA-N	-1	0	325.364	3.638	10	0		EHAERM
O=C([O-])c1cc(F)ccc1NC(=O)c1ccsc1Br	ZINC000704991902	977266143	/nfs/dbraw/zinc/26/61/43/977266143.db2.gz	NWKKSIWJSDDQTR-UHFFFAOYSA-N	-1	0	344.161	3.600	10	0		EHAERM
O=C([O-])c1csc(COc2cc(F)ccc2Br)c1	ZINC000711425702	977547193	/nfs/dbraw/zinc/54/71/93/977547193.db2.gz	VTSVWUXHARVHRF-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
COc1cc(Br)ccc1NCc1ccc(C(=O)[O-])cc1	ZINC000712285742	977579240	/nfs/dbraw/zinc/57/92/40/977579240.db2.gz	KEWRCXNMINNVGW-UHFFFAOYSA-N	-1	0	336.185	3.768	10	0		EHAERM
O=C([O-])c1cc(NC(=O)C[C@@H]2CC[C@H]3C[C@H]32)ccc1Br	ZINC000717658931	977905152	/nfs/dbraw/zinc/90/51/52/977905152.db2.gz	DMWMXQSERQLBQS-ATZCPNFKSA-N	-1	0	338.201	3.522	10	0		EHAERM
O=C([N-]S(=O)(=O)c1ccc2ccccc2c1)[C@@H]1CC12CCCCC2	ZINC000408479806	1019561384	/nfs/dbraw/zinc/56/13/84/1019561384.db2.gz	NEKPLEVQMBMZBW-KRWDZBQOSA-N	-1	0	343.448	3.615	10	0		EHAERM
COc1ccc([C@H]2C[C@H](C)N(C(=O)c3ccc(F)cc3[O-])C2)cc1	ZINC000123876938	1038093508	/nfs/dbraw/zinc/09/35/08/1038093508.db2.gz	FUYJVWMDRUAEIG-JSGCOSHPSA-N	-1	0	329.371	3.558	10	0		EHAERM
CCOC(=O)c1c(C)c(CCC(=O)[O-])n(Cc2cccc(C)c2)c1C	ZINC000049455121	214009227	/nfs/dbraw/zinc/00/92/27/214009227.db2.gz	HGZXHKBUPRBENV-UHFFFAOYSA-N	-1	0	343.423	3.656	10	0		EHAERM
CC[C@H](C(=O)[O-])n1c2cnccc2nc1SCc1cccc(F)c1	ZINC000049454621	214008979	/nfs/dbraw/zinc/00/89/79/214008979.db2.gz	YUVJBGHBWZQZLB-CQSZACIVSA-N	-1	0	345.399	3.898	10	0		EHAERM
CCCOc1ccccc1/C=C/C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000064873460	214812809	/nfs/dbraw/zinc/81/28/09/214812809.db2.gz	VNRZPMHBXDWJCH-FMIVXFBMSA-N	-1	0	325.364	3.826	10	0		EHAERM
COc1cc(Nc2ncnc3ccccc32)c(Cl)cc1C(=O)[O-]	ZINC000004228229	210148008	/nfs/dbraw/zinc/14/80/08/210148008.db2.gz	ORFDIBAZBFCLEJ-UHFFFAOYSA-N	-1	0	329.743	3.734	10	0		EHAERM
Oc1c(Br)cc(Br)cc1OC(F)(F)F	ZINC000038287449	213206891	/nfs/dbraw/zinc/20/68/91/213206891.db2.gz	RDTCUGVTOPIXGR-UHFFFAOYSA-N	-1	0	335.901	3.816	10	0		EHAERM
Cc1cc(Br)ccc1C(=O)Nc1ccc(C(=O)[O-])s1	ZINC000036829393	213121812	/nfs/dbraw/zinc/12/18/12/213121812.db2.gz	AHBSRMRYPGNQJO-UHFFFAOYSA-N	-1	0	340.198	3.770	10	0		EHAERM
CCCc1cc(Nc2ccc(C(=O)[O-])cc2)nc(-c2cccnc2)n1	ZINC000070455653	215694070	/nfs/dbraw/zinc/69/40/70/215694070.db2.gz	UIFDVNGBLLKDIG-UHFFFAOYSA-N	-1	0	334.379	3.933	10	0		EHAERM
CCc1nc(-c2ccc(Cl)cc2)nc(-n2ccc(C(=O)[O-])n2)c1C	ZINC000073681552	216409380	/nfs/dbraw/zinc/40/93/80/216409380.db2.gz	MAUFLTFIVDUKOM-UHFFFAOYSA-N	-1	0	342.786	3.552	10	0		EHAERM
O=C([O-])c1ccc(Nc2nc3c(c(C(F)(F)F)n2)CCCC3)cc1	ZINC000217023140	241230802	/nfs/dbraw/zinc/23/08/02/241230802.db2.gz	NPAPQBVEDKLZTC-UHFFFAOYSA-N	-1	0	337.301	3.816	10	0		EHAERM
CCc1ccc(-c2csc(NC(=O)[C@@H]3CCCO3)c2C(=O)[O-])cc1	ZINC000020334223	212120434	/nfs/dbraw/zinc/12/04/34/212120434.db2.gz	SFSHCCBOEDQRMS-AWEZNQCLSA-N	-1	0	345.420	3.793	10	0		EHAERM
C[C@@H]1CCc2c(sc(NC(=O)c3cccc(F)c3)c2C(=O)[O-])C1	ZINC000020333613	212120455	/nfs/dbraw/zinc/12/04/55/212120455.db2.gz	STQBTOXCKWFHGN-SECBINFHSA-N	-1	0	333.384	3.963	10	0		EHAERM
Cc1sc(NC(=O)CCCOc2ccccc2)c(C(=O)[O-])c1C	ZINC000020332746	212119937	/nfs/dbraw/zinc/11/99/37/212119937.db2.gz	ZINCOLUPPVLIEA-UHFFFAOYSA-N	-1	0	333.409	3.861	10	0		EHAERM
O=C(Nc1ccccc1Br)c1cc(F)c(F)c([O-])c1F	ZINC000019836477	212074167	/nfs/dbraw/zinc/07/41/67/212074167.db2.gz	YHXODROAXJYOQF-UHFFFAOYSA-N	-1	0	346.102	3.824	10	0		EHAERM
Cc1ccc(-c2c(C(=O)[O-])nnn2-c2cccc(C(F)(F)F)c2)cc1	ZINC000011759656	211245331	/nfs/dbraw/zinc/24/53/31/211245331.db2.gz	KLUKIKHQTSKLMB-UHFFFAOYSA-N	-1	0	347.296	3.960	10	0		EHAERM
O=C([O-])[C@H]1[C@@H](c2ccccc2)CCCN1C(=O)OCc1ccccc1	ZINC000725262394	563985839	/nfs/dbraw/zinc/98/58/39/563985839.db2.gz	VRCLCIGJFXSJBZ-QZTJIDSGSA-N	-1	0	339.391	3.656	10	0		EHAERM
CC(C)[C@@H]1CC[C@@H](C)C[C@]1(NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000299873232	564118268	/nfs/dbraw/zinc/11/82/68/564118268.db2.gz	QDPBBDIEAIDFSL-SIXWZSSISA-N	-1	0	333.428	3.828	10	0		EHAERM
C[C@@]1(C(=O)[O-])CCCN1Cc1cccc(Cl)c1Br	ZINC000719414057	969105290	/nfs/dbraw/zinc/10/52/90/969105290.db2.gz	QWJFCOCUESNUSS-ZDUSSCGKSA-N	-1	0	332.625	3.542	10	0		EHAERM
O=C([O-])C[C@@H]1CC[C@H](Nc2nc3cc(Br)ccc3o2)C1	ZINC000705890138	977299660	/nfs/dbraw/zinc/29/96/60/977299660.db2.gz	PGUSKVRJGNCURJ-SCZZXKLOSA-N	-1	0	339.189	3.646	10	0		EHAERM
COc1cc(C(=O)[O-])ccc1OC[C@H](C)COCc1ccccc1	ZINC000719418825	978002531	/nfs/dbraw/zinc/00/25/31/978002531.db2.gz	ICJQCGBVBIRSCE-CQSZACIVSA-N	-1	0	330.380	3.625	10	0		EHAERM
C[C@@H]1C[C@H](COc2cc(Br)cc(C(=O)[O-])c2)C[C@H](C)O1	ZINC000724388482	978226224	/nfs/dbraw/zinc/22/62/24/978226224.db2.gz	CLVMGWYGZVHOOT-URLYPYJESA-N	-1	0	343.217	3.730	10	0		EHAERM
O=C([O-])[C@H]1CCC[C@H](CC(=O)c2cccc(Br)c2)C1	ZINC000098090443	219082978	/nfs/dbraw/zinc/08/29/78/219082978.db2.gz	JOFLRYUOGPNRLS-JQWIXIFHSA-N	-1	0	325.202	3.913	10	0		EHAERM
CCOc1ccc(-c2cc(Nc3cccc(C(=O)[O-])c3)ncn2)cc1	ZINC000049455553	214009443	/nfs/dbraw/zinc/00/94/43/214009443.db2.gz	WJIRZHKYBCPRSC-UHFFFAOYSA-N	-1	0	335.363	3.984	10	0		EHAERM
CCc1c(C)nc(-c2ccccc2F)nc1N1CCCC[C@@H]1C(=O)[O-]	ZINC000070452179	215693057	/nfs/dbraw/zinc/69/30/57/215693057.db2.gz	IOMVKGCWERBJNQ-MRXNPFEDSA-N	-1	0	343.402	3.597	10	0		EHAERM
CSc1cccc(-n2nnc(C(=O)[O-])c2-c2cc(F)cc(F)c2)c1	ZINC000070456917	215694778	/nfs/dbraw/zinc/69/47/78/215694778.db2.gz	QDVWDJMONVCGRX-UHFFFAOYSA-N	-1	0	347.346	3.633	10	0		EHAERM
O=C([O-])Cc1ccc(Nc2ncnc3sc4c(c32)CCCC4)cc1	ZINC000020326253	212119498	/nfs/dbraw/zinc/11/94/98/212119498.db2.gz	AFGBVCWKGFTPPR-UHFFFAOYSA-N	-1	0	339.420	3.941	10	0		EHAERM
O=C([O-])c1ccnc(Oc2ccc(Cl)cc2Br)c1	ZINC000019813007	212071404	/nfs/dbraw/zinc/07/14/04/212071404.db2.gz	GARVURCPLYECBJ-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
COc1ccc(C(=O)[O-])cc1OCc1ccccc1Br	ZINC000019504723	212035275	/nfs/dbraw/zinc/03/52/75/212035275.db2.gz	YPYGUXGISAXBGZ-UHFFFAOYSA-N	-1	0	337.169	3.735	10	0		EHAERM
CCC[C@H]1CN(c2ccc(C(=O)[O-])cc2)CCN1C(=O)OC(C)(C)C	ZINC000039952685	132398468	/nfs/dbraw/zinc/39/84/68/132398468.db2.gz	FYDKKRBUSFSRED-INIZCTEOSA-N	-1	0	348.443	3.611	10	0		EHAERM
Cc1ccc(C(=O)Nc2ccc3nc(N(C)C)cc(C(=O)[O-])c3c2)cc1	ZINC000033260518	563966284	/nfs/dbraw/zinc/96/62/84/563966284.db2.gz	INUWVLHYXMGIAK-UHFFFAOYSA-N	-1	0	349.390	3.560	10	0		EHAERM
O=C([O-])[C@@H]1[C@H](c2ccccc2)CCCN1C(=O)OCc1ccccc1	ZINC000725262395	563985827	/nfs/dbraw/zinc/98/58/27/563985827.db2.gz	VRCLCIGJFXSJBZ-ROUUACIJSA-N	-1	0	339.391	3.656	10	0		EHAERM
O=C([O-])[C@H]1CN(C(=O)OCc2ccccc2)C[C@H]1C1CCCCC1	ZINC000675051657	564111791	/nfs/dbraw/zinc/11/17/91/564111791.db2.gz	WMAJPAILSVYFNE-IRXDYDNUSA-N	-1	0	331.412	3.536	10	0		EHAERM
CC[C@@H](C)CCNC(=O)Nc1cc(C(=O)[O-])ccc1Br	ZINC000696422744	954817447	/nfs/dbraw/zinc/81/74/47/954817447.db2.gz	KYFIWCFKAWZQJM-SECBINFHSA-N	-1	0	343.221	3.705	10	0		EHAERM
O=C([O-])CCN(Cc1coc(-c2cccs2)n1)Cc1ccccc1	ZINC000692496185	976512739	/nfs/dbraw/zinc/51/27/39/976512739.db2.gz	QTIIKLYFXBQONO-UHFFFAOYSA-N	-1	0	342.420	3.880	10	0		EHAERM
CC(F)(F)C1(C(=O)Nc2ccc(Br)c(C(=O)[O-])c2)CC1	ZINC000692824403	976549352	/nfs/dbraw/zinc/54/93/52/976549352.db2.gz	TWPKEPGEJNTHKA-UHFFFAOYSA-N	-1	0	348.143	3.521	10	0		EHAERM
CC(C)c1cc(Oc2cc(Br)cc(C(=O)[O-])c2)ncn1	ZINC000700734340	976967108	/nfs/dbraw/zinc/96/71/08/976967108.db2.gz	WIXKWKZXCHIOQX-UHFFFAOYSA-N	-1	0	337.173	3.853	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OC[C@H]2CCC(F)(F)C2)c1	ZINC000700751795	976968802	/nfs/dbraw/zinc/96/88/02/976968802.db2.gz	IYGCPFHGTLNCKG-QMMMGPOBSA-N	-1	0	335.144	3.962	10	0		EHAERM
CC(C)(C)[C@@H]1C[C@H]1C(=O)Nc1ccc(Br)cc1C(=O)[O-]	ZINC000704148199	977218631	/nfs/dbraw/zinc/21/86/31/977218631.db2.gz	WGGWIBIPACOOAP-MWLCHTKSSA-N	-1	0	340.217	3.768	10	0		EHAERM
CN1CC[C@H](CNC(=O)c2cc(F)c([O-])c(Cl)c2)c2ccccc21	ZINC000194475667	1028517370	/nfs/dbraw/zinc/51/73/70/1028517370.db2.gz	PMSIERCRPVSZAB-LLVKDONJSA-N	-1	0	348.805	3.538	10	0		EHAERM
CC(C)(C)c1cc(Br)c2oc(=O)c(C(=O)[O-])cc2c1	ZINC000053993930	214209996	/nfs/dbraw/zinc/20/99/96/214209996.db2.gz	YCDHSMJXMRBRQS-UHFFFAOYSA-N	-1	0	325.158	3.551	10	0		EHAERM
O=C([O-])CCCOc1cc2sc(=O)oc2c(-c2ccc(F)cc2)c1	ZINC000053994302	214210015	/nfs/dbraw/zinc/21/00/15/214210015.db2.gz	YWTYBEARBAFFOI-UHFFFAOYSA-N	-1	0	348.351	3.904	10	0		EHAERM
Nc1c(Nc2ccc(C(=O)[O-])cc2)ncnc1NC1CCCCCC1	ZINC000040800943	213389106	/nfs/dbraw/zinc/38/91/06/213389106.db2.gz	YBJUTHJHMHENNI-UHFFFAOYSA-N	-1	0	341.415	3.635	10	0		EHAERM
COc1ccc(Br)cc1CNc1ccc(C(=O)[O-])cc1	ZINC000037115557	213132400	/nfs/dbraw/zinc/13/24/00/213132400.db2.gz	FZVGTYDUJWOBQO-UHFFFAOYSA-N	-1	0	336.185	3.768	10	0		EHAERM
Cc1cccc(-c2c(C(=O)[O-])nnn2Cc2c(F)cccc2Cl)c1	ZINC000070457162	215695591	/nfs/dbraw/zinc/69/55/91/215695591.db2.gz	LULZADSHMOIZPK-UHFFFAOYSA-N	-1	0	345.761	3.793	10	0		EHAERM
CCN(c1ccccc1)c1nc(OCC(=O)[O-])cc(-c2ccccc2)n1	ZINC000073698260	216413309	/nfs/dbraw/zinc/41/33/09/216413309.db2.gz	SFACJEZRPSAEAO-UHFFFAOYSA-N	-1	0	349.390	3.765	10	0		EHAERM
CCc1cc(C(=O)[O-])c(NC(=O)c2ccc(Br)o2)s1	ZINC000020333269	212120853	/nfs/dbraw/zinc/12/08/53/212120853.db2.gz	HBLVPVFWRQPKMP-UHFFFAOYSA-N	-1	0	344.186	3.617	10	0		EHAERM
Cc1sc(NC(=O)[C@H]2CCCO2)c(C(=O)[O-])c1-c1ccccc1	ZINC000020334397	212120551	/nfs/dbraw/zinc/12/05/51/212120551.db2.gz	RIDUPSUZWPMBSD-GFCCVEGCSA-N	-1	0	331.393	3.539	10	0		EHAERM
CC(C)c1ccc2c(c1)N(C(=O)OCc1ccccc1)[C@@H](C(=O)[O-])C2	ZINC000584881820	563879637	/nfs/dbraw/zinc/87/96/37/563879637.db2.gz	BYNSGMVGWFDGHR-GOSISDBHSA-N	-1	0	339.391	3.963	10	0		EHAERM
Cc1c(F)c(Br)ccc1NC(=O)[C@@H](C(=O)[O-])C(C)(C)C	ZINC000694014624	954771810	/nfs/dbraw/zinc/77/18/10/954771810.db2.gz	CDYKAHYKFRSBFK-JTQLQIEISA-N	-1	0	346.196	3.582	10	0		EHAERM
CC1(C)C[C@H](Sc2ccc(Br)cc2C(=O)[O-])CO1	ZINC000703058869	977150114	/nfs/dbraw/zinc/15/01/14/977150114.db2.gz	XFHVNUOQDJPTRZ-VIFPVBQESA-N	-1	0	331.231	3.807	10	0		EHAERM
O=C([O-])c1csc(CSc2ccc(Br)cn2)c1	ZINC000711408427	977544551	/nfs/dbraw/zinc/54/45/51/977544551.db2.gz	XLKPWIHRWPIROI-UHFFFAOYSA-N	-1	0	330.228	3.896	10	0		EHAERM
O=C([O-])c1csc(COc2ccc(F)c(Br)c2)c1	ZINC000711424495	977546820	/nfs/dbraw/zinc/54/68/20/977546820.db2.gz	PJWBXJGKASUMJI-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
C[C@H](C(=O)N1C[C@@H](c2ccccc2)C[C@H](C(=O)[O-])C1)c1cccs1	ZINC000180340194	1031881134	/nfs/dbraw/zinc/88/11/34/1031881134.db2.gz	RXRAUGYEPGZZKF-BPUTZDHNSA-N	-1	0	343.448	3.569	10	0		EHAERM
C[C@@H](Nc1ncc(Br)cc1C(=O)[O-])C1CCCCC1	ZINC000104179790	219355809	/nfs/dbraw/zinc/35/58/09/219355809.db2.gz	QAHRAGDMOWZWIH-SECBINFHSA-N	-1	0	327.222	3.923	10	0		EHAERM
O=C([O-])c1cc(Br)ccc1OCCc1cccs1	ZINC000104271882	219368232	/nfs/dbraw/zinc/36/82/32/219368232.db2.gz	QBJPQXWHSBRROB-UHFFFAOYSA-N	-1	0	327.199	3.830	10	0		EHAERM
O=C([O-])c1sccc1C[S@@](=O)c1ccccc1Br	ZINC000104343790	219376761	/nfs/dbraw/zinc/37/67/61/219376761.db2.gz	NKTYFRFRXUZLSK-SFHVURJKSA-N	-1	0	345.239	3.517	10	0		EHAERM
CC(C)(C)n1cc(C(=O)[O-])c(-c2ccc(Br)s2)n1	ZINC000038002142	213187391	/nfs/dbraw/zinc/18/73/91/213187391.db2.gz	HRRQNFRYVMTCOA-UHFFFAOYSA-N	-1	0	329.219	3.827	10	0		EHAERM
COc1ccc(-n2nnc(C(=O)[O-])c2-c2cccc(C)c2)cc1Cl	ZINC000070456878	215694376	/nfs/dbraw/zinc/69/43/76/215694376.db2.gz	ZRPOTIKQSNWHCX-UHFFFAOYSA-N	-1	0	343.770	3.603	10	0		EHAERM
O=c1cc(-c2nc(-c3ccc(Oc4ccccc4)cc3)no2)cc([O-])[nH]1	ZINC000073638040	216404831	/nfs/dbraw/zinc/40/48/31/216404831.db2.gz	FEXCLSBUCZLIPJ-UHFFFAOYSA-N	-1	0	347.330	3.590	10	0		EHAERM
CCCCC(=O)Nc1nc(-c2ccc(OCC(=O)[O-])cc2)c(C)s1	ZINC000020340534	212120796	/nfs/dbraw/zinc/12/07/96/212120796.db2.gz	KNBXBDCMPGWODF-UHFFFAOYSA-N	-1	0	348.424	3.711	10	0		EHAERM
COc1ccccc1C(=O)Nc1sc2c(c1C(=O)[O-])CCCCC2	ZINC000020334833	212120412	/nfs/dbraw/zinc/12/04/12/212120412.db2.gz	SOARZCIILQGKEP-UHFFFAOYSA-N	-1	0	345.420	3.976	10	0		EHAERM
Cc1sc2ncnc(N(C)CCC(=O)[O-])c2c1-c1ccccc1	ZINC000020317858	212118953	/nfs/dbraw/zinc/11/89/53/212118953.db2.gz	OHGYWSBBQWGENL-UHFFFAOYSA-N	-1	0	327.409	3.578	10	0		EHAERM
O=C([O-])c1ccccc1/C=C1/SC(=O)N(c2ccccc2)C1=O	ZINC000016905133	211941265	/nfs/dbraw/zinc/94/12/65/211941265.db2.gz	HAHQPRSAIOUICM-GXDHUFHOSA-N	-1	0	325.345	3.626	10	0		EHAERM
CCN1C(=O)c2ccccc2[C@H](C(=O)[O-])[C@H]1c1c[nH]c2ccccc21	ZINC000033413902	563916060	/nfs/dbraw/zinc/91/60/60/563916060.db2.gz	RBLLRIFMUHIHIS-ZWKOTPCHSA-N	-1	0	334.375	3.553	10	0		EHAERM
O=C([O-])C1(CNC(=O)OCc2ccccc2)CC(c2ccccc2)C1	ZINC000722622847	563935356	/nfs/dbraw/zinc/93/53/56/563935356.db2.gz	KGCPJBAWWRETLQ-UHFFFAOYSA-N	-1	0	339.391	3.561	10	0		EHAERM
CC(C)(C)OC(=O)N[C@@H](CCc1cccc2ccccc21)C(=O)[O-]	ZINC000059902265	563949454	/nfs/dbraw/zinc/94/94/54/563949454.db2.gz	NJBRIISKLYUGBL-INIZCTEOSA-N	-1	0	329.396	3.750	10	0		EHAERM
O=C([O-])C[C@H]1CCN(C(=O)OCc2ccccc2)c2ccccc21	ZINC000675073125	564112773	/nfs/dbraw/zinc/11/27/73/564112773.db2.gz	RIXWWRJVHCASSS-OAHLLOKOSA-N	-1	0	325.364	3.792	10	0		EHAERM
O=C([O-])c1ccc(CN2CCc3cc(Br)ccc32)cc1	ZINC000713333756	969074463	/nfs/dbraw/zinc/07/44/63/969074463.db2.gz	VUXQFIOAKOEKLE-UHFFFAOYSA-N	-1	0	332.197	3.710	10	0		EHAERM
CC(C)(C)[C@@H]1C[C@H]1C(=O)Nc1ccc(Br)c(C(=O)[O-])c1	ZINC000699983253	976932001	/nfs/dbraw/zinc/93/20/01/976932001.db2.gz	SBZFEGIIWPAQOV-MWLCHTKSSA-N	-1	0	340.217	3.768	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OCc2ccc(F)cc2)c1	ZINC000700739184	976967204	/nfs/dbraw/zinc/96/72/04/976967204.db2.gz	HECMEFWOEVBERZ-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
Cc1cocc1C(=O)Nc1cc(C(=O)[O-])c(Br)cc1C	ZINC000704760957	977253115	/nfs/dbraw/zinc/25/31/15/977253115.db2.gz	CXIGJTREUHLBSZ-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
Cc1cc(CN2CCc3ccc(Br)cc32)oc1C(=O)[O-]	ZINC000713324102	977632846	/nfs/dbraw/zinc/63/28/46/977632846.db2.gz	IGPWBDAKLNEOMR-UHFFFAOYSA-N	-1	0	336.185	3.611	10	0		EHAERM
O=C(c1cc(F)c(F)c([O-])c1F)N1CC=C(c2cccs2)CC1	ZINC000183639728	1032214420	/nfs/dbraw/zinc/21/44/20/1032214420.db2.gz	UZCRCCXCSAAEPR-UHFFFAOYSA-N	-1	0	339.338	3.801	10	0		EHAERM
O=C(c1cc(F)cc(Cl)c1[O-])N1CCC[C@H](c2nccs2)C1	ZINC000132160619	1027886081	/nfs/dbraw/zinc/88/60/81/1027886081.db2.gz	WDFXUESURLHGQU-VIFPVBQESA-N	-1	0	340.807	3.661	10	0		EHAERM
Cc1[nH]c2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@H]4CCCC[C@@H]43)cc2c1C	ZINC000237738394	1029816738	/nfs/dbraw/zinc/81/67/38/1029816738.db2.gz	QWGXZPXVOCWLFD-BVGQSLNGSA-N	-1	0	340.423	3.643	10	0		EHAERM
O=C([O-])[C@@H]1C[C@@H](c2ccccc2)CN(C(=O)c2coc3ccccc23)C1	ZINC000180303687	1031878133	/nfs/dbraw/zinc/87/81/33/1031878133.db2.gz	NCFAGUIMGCMQQL-HZPDHXFCSA-N	-1	0	349.386	3.763	10	0		EHAERM
COc1ccc([C@@H]2C[C@H](C)N(C(=O)c3cc(F)c([O-])c(F)c3)C2)cc1	ZINC000186823211	1035710110	/nfs/dbraw/zinc/71/01/10/1035710110.db2.gz	ZCQNEOJYQXVTNW-SMDDNHRTSA-N	-1	0	347.361	3.697	10	0		EHAERM
COc1ccc2c(c1)CCCCN2C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000049454513	214009508	/nfs/dbraw/zinc/00/95/08/214009508.db2.gz	GJXJPTQQHWFBIR-UHFFFAOYSA-N	-1	0	340.379	3.768	10	0		EHAERM
CCCCOc1ccc(/C=C/C(=O)NCCCCCC(=O)[O-])cc1	ZINC000040867893	213395773	/nfs/dbraw/zinc/39/57/73/213395773.db2.gz	MPFVKZKHDLILOG-JLHYYAGUSA-N	-1	0	333.428	3.640	10	0		EHAERM
Cc1nn(C)c(Oc2ccc(Cl)c(Cl)c2)c1/C=C/C(=O)[O-]	ZINC000038001553	213186014	/nfs/dbraw/zinc/18/60/14/213186014.db2.gz	JZTDCWMVFNUPGQ-GQCTYLIASA-N	-1	0	327.167	3.925	10	0		EHAERM
CCc1c(C)nc(-c2cccc(F)c2)nc1N1CCCC[C@H]1C(=O)[O-]	ZINC000070452166	215692588	/nfs/dbraw/zinc/69/25/88/215692588.db2.gz	MDLMDETYUARRGE-INIZCTEOSA-N	-1	0	343.402	3.597	10	0		EHAERM
O=C([O-])c1nnn(Cc2cc(F)ccc2F)c1-c1cccc(Cl)c1	ZINC000070457081	215694411	/nfs/dbraw/zinc/69/44/11/215694411.db2.gz	YYCAPJSQIJIUEB-UHFFFAOYSA-N	-1	0	349.724	3.623	10	0		EHAERM
Cc1ccc(-n2nc(C(=O)[O-])c3c2CCCC3)c(Br)c1	ZINC000022145336	212279070	/nfs/dbraw/zinc/27/90/70/212279070.db2.gz	MBLJBEWDCOENSW-UHFFFAOYSA-N	-1	0	335.201	3.520	10	0		EHAERM
O=C([O-])CC(=O)Nc1ccccc1-c1ccc(Br)cc1	ZINC000069593653	563963585	/nfs/dbraw/zinc/96/35/85/563963585.db2.gz	OLARTRBNFWVAKV-UHFFFAOYSA-N	-1	0	334.169	3.529	10	0		EHAERM
CC(C)(C)OC(=O)NOC1(CC(=O)[O-])CCC(C(C)(C)C)CC1	ZINC000675055102	564084337	/nfs/dbraw/zinc/08/43/37/564084337.db2.gz	PZHGWFXNXDXBNB-UHFFFAOYSA-N	-1	0	329.437	3.893	10	0		EHAERM
O=[S@]([O-])c1ccc(Oc2cccc(F)c2)c(Br)c1	ZINC000675061221	564112284	/nfs/dbraw/zinc/11/22/84/564112284.db2.gz	DHJYOTNJGVTROX-UHFFFAOYSA-N	-1	0	331.162	3.961	10	0		EHAERM
C[C@@H]1CC[C@H](C)N1C(=O)Nc1cc(C(=O)[O-])ccc1Br	ZINC000707000535	954961444	/nfs/dbraw/zinc/96/14/44/954961444.db2.gz	AINZCZWWQJLRLN-DTORHVGOSA-N	-1	0	341.205	3.552	10	0		EHAERM
O=C([O-])c1ccc(CN2CCc3ccc(Br)cc32)cc1	ZINC000713325184	955094974	/nfs/dbraw/zinc/09/49/74/955094974.db2.gz	SOIIRBBHSQSAFQ-UHFFFAOYSA-N	-1	0	332.197	3.710	10	0		EHAERM
Cc1oc(C(=O)[O-])cc1C(=O)Nc1cccc(Br)c1C	ZINC000689118613	976227746	/nfs/dbraw/zinc/22/77/46/976227746.db2.gz	PZGMKKIYJNKUEB-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
Cc1sc(NCC2(CCOCc3ccccc3)CC2)nc1C(=O)[O-]	ZINC000702141087	977065893	/nfs/dbraw/zinc/06/58/93/977065893.db2.gz	KAJFJURLPTYBJS-UHFFFAOYSA-N	-1	0	346.452	3.949	10	0		EHAERM
O=C([O-])c1cc(Br)ccc1NC(=O)C[C@@H]1C[C@H]1C1CC1	ZINC000711924485	977578169	/nfs/dbraw/zinc/57/81/69/977578169.db2.gz	FQIQICZBDPPEBG-ONGXEEELSA-N	-1	0	338.201	3.522	10	0		EHAERM
O=C([O-])[C@@H](c1ccccc1)N1CCc2ccc(Br)cc21	ZINC000713324039	977632928	/nfs/dbraw/zinc/63/29/28/977632928.db2.gz	FZSFMOIXSIRYTN-OAHLLOKOSA-N	-1	0	332.197	3.638	10	0		EHAERM
C[C@@H](COCc1ccccc1)CN1CCc2ccc(C(=O)[O-])cc21	ZINC000719495655	978004560	/nfs/dbraw/zinc/00/45/60/978004560.db2.gz	DZJRZYUZTNIAAE-OAHLLOKOSA-N	-1	0	325.408	3.600	10	0		EHAERM
O=C(c1nn(-c2ccccc2)cc1[O-])N1CC=C(c2ccccc2)CC1	ZINC000073047313	1028536463	/nfs/dbraw/zinc/53/64/63/1028536463.db2.gz	DYAXFTVVQBYJSP-UHFFFAOYSA-N	-1	0	345.402	3.507	10	0		EHAERM
CCOc1cc2[n-]cc3c(=O)n(-c4ccccc4)nc-3c2cc1OCC	ZINC000053994680	214210251	/nfs/dbraw/zinc/21/02/51/214210251.db2.gz	PNWCZYNRMQTVEP-UHFFFAOYSA-N	-1	0	349.390	3.664	10	0		EHAERM
O=C([O-])c1c(-c2ccc(F)cc2)nn2ccc(Br)cc12	ZINC000097758459	219054887	/nfs/dbraw/zinc/05/48/87/219054887.db2.gz	XSTOINNOGCFTQN-UHFFFAOYSA-N	-1	0	335.132	3.601	10	0		EHAERM
Cc1ccccc1[C@@](O[C@@H]1CCCCN1C)(C(=O)[O-])c1ccccc1	ZINC000098089781	219083010	/nfs/dbraw/zinc/08/30/10/219083010.db2.gz	SSDWPUFYQALBIE-TZIWHRDSSA-N	-1	0	339.435	3.782	10	0		EHAERM
CC(C)c1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C(=O)[O-])cc1	ZINC000098091558	219083072	/nfs/dbraw/zinc/08/30/72/219083072.db2.gz	JDEWSAXOVLKJBE-CVEARBPZSA-N	-1	0	333.428	3.845	10	0		EHAERM
O=C([O-])c1c(N2CCCC2=O)c2ccccc2n1Cc1ccccc1	ZINC000049453974	214008948	/nfs/dbraw/zinc/00/89/48/214008948.db2.gz	XJNLQGZTGZFHJI-UHFFFAOYSA-N	-1	0	334.375	3.515	10	0		EHAERM
CCc1nn2c(nc(C)cc2SCC(=O)[O-])c1-c1ccc(C)cc1	ZINC000049453331	214008105	/nfs/dbraw/zinc/00/81/05/214008105.db2.gz	SQJIDXFALZUZCD-UHFFFAOYSA-N	-1	0	341.436	3.752	10	0		EHAERM
O=C([O-])C[C@@H]1CCCCN1C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000038026752	213193325	/nfs/dbraw/zinc/19/33/25/213193325.db2.gz	GPMLHOIXXNQUQO-JTQLQIEISA-N	-1	0	331.199	3.855	10	0		EHAERM
O=S(=O)([N-]c1cccc(C(F)(F)F)c1)c1ccnc(Cl)c1	ZINC000038008500	213189274	/nfs/dbraw/zinc/18/92/74/213189274.db2.gz	IAGPLADZKDJFBU-UHFFFAOYSA-N	-1	0	336.722	3.555	10	0		EHAERM
O=C([O-])[C@@H](Cc1ccccc1)Sc1ccc(Br)cn1	ZINC000037528130	213154618	/nfs/dbraw/zinc/15/46/18/213154618.db2.gz	DLIVFRNCQYXXLQ-GFCCVEGCSA-N	-1	0	338.226	3.632	10	0		EHAERM
COc1cc(/C=C/C(=O)[O-])cc(Br)c1OC/C=C/Cl	ZINC000036815556	213119999	/nfs/dbraw/zinc/11/99/99/213119999.db2.gz	KKMAJDUCYFOJLG-JWVZGZSZSA-N	-1	0	347.592	3.687	10	0		EHAERM
CC(C)[C@](C)(CC(=O)Nc1cccc(Br)c1)C(=O)[O-]	ZINC000035125761	213009168	/nfs/dbraw/zinc/00/91/68/213009168.db2.gz	BXOIFAIAJOCYLQ-AWEZNQCLSA-N	-1	0	328.206	3.525	10	0		EHAERM
Cc1cccc(C)c1Nc1nc(OCC(=O)[O-])cc(C(C)(C)C)n1	ZINC000073697311	216412381	/nfs/dbraw/zinc/41/23/81/216412381.db2.gz	BMVOIILGDSJBTG-UHFFFAOYSA-N	-1	0	329.400	3.598	10	0		EHAERM
Cc1cc(Br)ccc1-n1nc(C(=O)[O-])c2c1CCCC2	ZINC000021965158	212266762	/nfs/dbraw/zinc/26/67/62/212266762.db2.gz	KMQFXOVZTMLFEG-UHFFFAOYSA-N	-1	0	335.201	3.520	10	0		EHAERM
CC(C)(C)[C@@H]1CCCC[C@]1(NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000226769103	564118259	/nfs/dbraw/zinc/11/82/59/564118259.db2.gz	ZEHMJQJVAHUPOO-HNAYVOBHSA-N	-1	0	333.428	3.973	10	0		EHAERM
Nc1nc(Nc2cccc(Cl)c2)nc(-c2cc(Cl)ccc2[O-])n1	ZINC000048523190	564129251	/nfs/dbraw/zinc/12/92/51/564129251.db2.gz	MACZNSZHTHDOEF-UHFFFAOYSA-N	-1	0	348.193	3.877	10	0		EHAERM
CC[C@]1(C(=O)[O-])C[C@@H](C2CC2)C[C@H]1NC(=O)OCc1ccccc1	ZINC000685958789	564177070	/nfs/dbraw/zinc/17/70/70/564177070.db2.gz	GOYWLRYGLZWYEK-FCEWJHQRSA-N	-1	0	331.412	3.582	10	0		EHAERM
COc1ccc2c(c1)N(C(=O)OC(C)C)[C@@H](CSC)C(=S)N2	ZINC000003870431	581097427	/nfs/dbraw/zinc/09/74/27/581097427.db2.gz	GWKIPRVERALPRD-ZDUSSCGKSA-N	-1	0	340.470	3.531	10	0	investigational	EHAERM
O=C([O-])[C@@H]1CC[C@H](c2nc(-c3sccc3Br)no2)C1	ZINC000723218758	955201115	/nfs/dbraw/zinc/20/11/15/955201115.db2.gz	AAQOAKSXUUAXPS-NKWVEPMBSA-N	-1	0	343.202	3.529	10	0		EHAERM
O=C([O-])C1(c2csc(Nc3cccc(Br)c3)n2)CC1	ZINC000690467664	976301943	/nfs/dbraw/zinc/30/19/43/976301943.db2.gz	RIAWSISCOWSYBQ-UHFFFAOYSA-N	-1	0	339.214	3.765	10	0		EHAERM
Cc1cc(NC(=O)c2ccsc2Br)sc1C(=O)[O-]	ZINC000698700388	976900159	/nfs/dbraw/zinc/90/01/59/976900159.db2.gz	YCOXXIDUYBNBEK-UHFFFAOYSA-N	-1	0	346.227	3.831	10	0		EHAERM
O=C([O-])C1(CNc2ncc(Cl)cc2Br)CCCC1	ZINC000707042295	977373588	/nfs/dbraw/zinc/37/35/88/977373588.db2.gz	DRFKCXBULKQZRN-UHFFFAOYSA-N	-1	0	333.613	3.554	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21	ZINC000717662684	977905197	/nfs/dbraw/zinc/90/51/97/977905197.db2.gz	VZXPFBKPNZQQBK-PTRXPTGYSA-N	-1	0	338.201	3.522	10	0		EHAERM
Cc1nc([C@@H]2CCCN2C(=O)c2cc(F)c(F)c([O-])c2F)cs1	ZINC000190009853	1140379384	/nfs/dbraw/zinc/37/93/84/1140379384.db2.gz	FHFKZWOSCRWEQK-NSHDSACASA-N	-1	0	342.342	3.552	10	0		EHAERM
CC[C@H](C(=O)[O-])[C@@](C)(O)c1cc2cc(Br)ccc2o1	ZINC000052260556	214124781	/nfs/dbraw/zinc/12/47/81/214124781.db2.gz	VHCLMANNLZVNCO-QMTHXVAHSA-N	-1	0	327.174	3.514	10	0		EHAERM
CCOc1cccc(-c2ccc(Nc3cccc(C(=O)[O-])c3)nn2)c1	ZINC000049455761	214009121	/nfs/dbraw/zinc/00/91/21/214009121.db2.gz	BGRCVTXVZGGZRS-UHFFFAOYSA-N	-1	0	335.363	3.984	10	0		EHAERM
COC(=O)c1ccc(Cl)c(-c2cnc(Cl)c(C(=O)[O-])c2)c1	ZINC000065349013	214873142	/nfs/dbraw/zinc/87/31/42/214873142.db2.gz	FYJLIEVZFBJEBU-UHFFFAOYSA-N	-1	0	326.135	3.540	10	0		EHAERM
O=C([O-])c1cc(Br)cnc1Nc1ccccc1Cl	ZINC000104172194	219354346	/nfs/dbraw/zinc/35/43/46/219354346.db2.gz	NZDTZRJDKDBCHS-UHFFFAOYSA-N	-1	0	327.565	3.939	10	0		EHAERM
O=C([O-])CCN(Cc1csc(Br)c1)c1ccccc1	ZINC000037595232	213160049	/nfs/dbraw/zinc/16/00/49/213160049.db2.gz	VLWPUOKOLHOMRQ-UHFFFAOYSA-N	-1	0	340.242	3.992	10	0		EHAERM
O=C([O-])c1ccccc1Cc1ccc(I)cc1	ZINC000036433771	213097768	/nfs/dbraw/zinc/09/77/68/213097768.db2.gz	CZXHQYVZHPCXIQ-UHFFFAOYSA-N	-1	0	338.144	3.580	10	0		EHAERM
CCc1c(C)nc(-c2cccc(F)c2)nc1N1CCCC[C@@H]1C(=O)[O-]	ZINC000070452165	215692269	/nfs/dbraw/zinc/69/22/69/215692269.db2.gz	MDLMDETYUARRGE-MRXNPFEDSA-N	-1	0	343.402	3.597	10	0		EHAERM
Cc1cccc(-c2cc(OCC(=O)[O-])nc(-c3cccc(F)c3)n2)c1	ZINC000073696490	216413215	/nfs/dbraw/zinc/41/32/15/216413215.db2.gz	GQHMRVPTCNVSLP-UHFFFAOYSA-N	-1	0	338.338	3.722	10	0		EHAERM
CC(C)(C)C1CC(=C([O-])C(F)(F)F)C(O)=C(C(=O)C(F)(F)F)C1	ZINC000199789693	241039842	/nfs/dbraw/zinc/03/98/42/241039842.db2.gz	SXXAGMRKHAMBDV-HTQZYQBOSA-N	-1	0	346.267	3.507	10	0		EHAERM
O=C([O-])c1ccccc1-c1nc(-c2cccc(Br)c2)no1	ZINC000020596242	212150247	/nfs/dbraw/zinc/15/02/47/212150247.db2.gz	PTBDQTZMCBNOSR-UHFFFAOYSA-N	-1	0	345.152	3.864	10	0		EHAERM
CC[C@H](Sc1nc(=O)c2c(-c3ccccc3)csc2[nH]1)C(=O)[O-]	ZINC000019955088	212089888	/nfs/dbraw/zinc/08/98/88/212089888.db2.gz	OHLMIGQXWVLIOK-NSHDSACASA-N	-1	0	346.433	3.607	10	0		EHAERM
O=C([O-])CCCCCCCCCCCCCCOC[C@@H](O)CO	ZINC000009970460	211137742	/nfs/dbraw/zinc/13/77/42/211137742.db2.gz	RWZSTWIUXVUUJT-KRWDZBQOSA-N	-1	0	332.481	3.512	10	0		EHAERM
CC(C)(C)OC(=O)N[C@H](CCc1cccc(Cl)c1Cl)C(=O)[O-]	ZINC000095749208	218447642	/nfs/dbraw/zinc/44/76/42/218447642.db2.gz	SPCVXGZMPHLKGR-LLVKDONJSA-N	-1	0	348.226	3.904	10	0		EHAERM
O=C([O-])[C@@H]1CCC(=O)N(c2ccccc2)[C@H]1c1ccc(Cl)cc1	ZINC000049452855	132430819	/nfs/dbraw/zinc/43/08/19/132430819.db2.gz	SXUBJRJCRQCMES-WBVHZDCISA-N	-1	0	329.783	3.909	10	0		EHAERM
COCCOc1ccc(-c2cc(-c3cccc(C(=O)[O-])c3)on2)cc1	ZINC000082049832	563971977	/nfs/dbraw/zinc/97/19/77/563971977.db2.gz	RLKOQMNQIJKFCV-UHFFFAOYSA-N	-1	0	339.347	3.732	10	0		EHAERM
O=C([O-])c1cc(COc2ccc(Br)cc2F)cs1	ZINC000689108388	976224796	/nfs/dbraw/zinc/22/47/96/976224796.db2.gz	NJGUQQXQOQZERQ-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
O=C([O-])c1ccc(CNc2cc(F)c(Br)c(F)c2)o1	ZINC000689665623	976259724	/nfs/dbraw/zinc/25/97/24/976259724.db2.gz	MOWZPTBGWGPJGE-UHFFFAOYSA-N	-1	0	332.100	3.631	10	0		EHAERM
C/C(=C\C(=O)[O-])COc1cc(C(F)(F)F)ccc1Br	ZINC000697594520	976851386	/nfs/dbraw/zinc/85/13/86/976851386.db2.gz	QCSRWIFDQJHVBF-QPJJXVBHSA-N	-1	0	339.107	3.878	10	0		EHAERM
C/C(=C/C(=O)[O-])COc1cc(C(F)(F)F)ccc1Br	ZINC000697594518	976851941	/nfs/dbraw/zinc/85/19/41/976851941.db2.gz	QCSRWIFDQJHVBF-DAXSKMNVSA-N	-1	0	339.107	3.878	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OC/C(Cl)=C/Cl)c1	ZINC000700715590	976965488	/nfs/dbraw/zinc/96/54/88/976965488.db2.gz	COPVCOVNKUIFBJ-YWEYNIOJSA-N	-1	0	325.973	3.845	10	0		EHAERM
Cc1cc(C(=O)Nc2cc(Br)ccc2C)oc1C(=O)[O-]	ZINC000704794224	977258554	/nfs/dbraw/zinc/25/85/54/977258554.db2.gz	FTGVWPIBBZMXOQ-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
CN(Cc1cscc1Br)[C@H](C(=O)[O-])c1ccccc1	ZINC000709867445	977471645	/nfs/dbraw/zinc/47/16/45/977471645.db2.gz	CRXHMJSVKNLXKN-ZDUSSCGKSA-N	-1	0	340.242	3.768	10	0		EHAERM
O=C([O-])c1cnc(NC(=O)c2cc(F)c(Cl)cc2Cl)s1	ZINC000720013975	978021429	/nfs/dbraw/zinc/02/14/29/978021429.db2.gz	OLQVALKJEPYTEW-UHFFFAOYSA-N	-1	0	335.143	3.540	10	0		EHAERM
O=C([O-])c1ccc(OCc2scnc2Cl)c(Br)c1	ZINC000722014874	978132931	/nfs/dbraw/zinc/13/29/31/978132931.db2.gz	NZTGGOLFIUATMS-UHFFFAOYSA-N	-1	0	348.605	3.836	10	0		EHAERM
CN(Cc1ccsc1C(=O)[O-])c1ccc(Br)cc1	ZINC000723902592	978220869	/nfs/dbraw/zinc/22/08/69/978220869.db2.gz	YTRVNWIQFSQINF-UHFFFAOYSA-N	-1	0	326.215	3.845	10	0		EHAERM
O=C(c1nn(-c2ccccc2F)cc1[O-])N1CCC[C@H]2CCCC[C@@H]21	ZINC000408006091	1016864355	/nfs/dbraw/zinc/86/43/55/1016864355.db2.gz	XTZFNDJILRGFOW-HIFRSBDPSA-N	-1	0	343.402	3.512	10	0		EHAERM
Cc1ccccc1[C@@](O[C@H]1CCCCN1C)(C(=O)[O-])c1ccccc1	ZINC000098089783	219083432	/nfs/dbraw/zinc/08/34/32/219083432.db2.gz	SSDWPUFYQALBIE-PZJWPPBQSA-N	-1	0	339.435	3.782	10	0		EHAERM
Cc1oc(-c2ccc(C(=O)[O-])cc2)nc1C[S@@](=O)c1ccccc1	ZINC000049454351	214009502	/nfs/dbraw/zinc/00/95/02/214009502.db2.gz	YZUPBEAKXUPPDR-DEOSSOPVSA-N	-1	0	341.388	3.656	10	0		EHAERM
Cc1ccccc1Nc1ncnc(Nc2ccc(C(=O)[O-])cc2)c1N	ZINC000040781256	213385514	/nfs/dbraw/zinc/38/55/14/213385514.db2.gz	SIFHDJLORDPVRY-UHFFFAOYSA-N	-1	0	335.367	3.553	10	0		EHAERM
Nc1ccc(Nc2cc(Br)ccc2F)c(C(=O)[O-])c1	ZINC000037931005	213175384	/nfs/dbraw/zinc/17/53/84/213175384.db2.gz	SOYUSCCGKOCDRP-UHFFFAOYSA-N	-1	0	325.137	3.612	10	0		EHAERM
Cc1ccc(Nc2nc3c(c(OCC(=O)[O-])n2)CCCC3)cc1Cl	ZINC000073704265	216415201	/nfs/dbraw/zinc/41/52/01/216415201.db2.gz	YUXYBTXNKLWGKK-UHFFFAOYSA-N	-1	0	347.802	3.524	10	0		EHAERM
COc1ccc2c(CC(=O)[O-])cn(C(=O)c3ccc(Cl)cc3)c2c1	ZINC000204651836	241042529	/nfs/dbraw/zinc/04/25/29/241042529.db2.gz	UGBBTQDVGVDVKG-UHFFFAOYSA-N	-1	0	343.766	3.619	10	0		EHAERM
CCc1ccc(-c2csc(NC(=O)[C@H]3CCCO3)c2C(=O)[O-])cc1	ZINC000020334226	212120777	/nfs/dbraw/zinc/12/07/77/212120777.db2.gz	SFSHCCBOEDQRMS-CQSZACIVSA-N	-1	0	345.420	3.793	10	0		EHAERM
O=C([O-])c1ccccc1/C=C1/SC(=O)N(c2ccccc2F)C1=O	ZINC000016905141	211941112	/nfs/dbraw/zinc/94/11/12/211941112.db2.gz	JTRAYEWLBXILAR-NTEUORMPSA-N	-1	0	343.335	3.765	10	0		EHAERM
Cc1ccc(-n2nnc(C(=O)[O-])c2CSc2ccccc2)cc1C	ZINC000011759520	211245202	/nfs/dbraw/zinc/24/52/02/211245202.db2.gz	VUSMVENXNOMPKJ-UHFFFAOYSA-N	-1	0	339.420	3.875	10	0		EHAERM
CC(C)(C)OC(=O)NC[C@@H](Cc1cccc(Cl)c1Cl)C(=O)[O-]	ZINC000095750540	218447425	/nfs/dbraw/zinc/44/74/25/218447425.db2.gz	NYGSSEHNKWWCON-SNVBAGLBSA-N	-1	0	348.226	3.761	10	0		EHAERM
COc1c(Cl)ccc(Cl)c1C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000005511943	210478410	/nfs/dbraw/zinc/47/84/10/210478410.db2.gz	LMZXQMSUWRRVLP-UHFFFAOYSA-N	-1	0	340.162	3.953	10	0		EHAERM
CCOc1cc(/C=C\C(=O)[O-])cc(Br)c1OCC(C)C	ZINC000097563373	219035675	/nfs/dbraw/zinc/03/56/75/219035675.db2.gz	UHJWEHULFISUOW-WAYWQWQTSA-N	-1	0	343.217	3.980	10	0		EHAERM
Cc1c(C(=O)[O-])oc2c1-c1nn(Cc3ccccc3Cl)cc1CC2	ZINC000006751397	563585277	/nfs/dbraw/zinc/58/52/77/563585277.db2.gz	LSHKZOSNEQNWBO-UHFFFAOYSA-N	-1	0	342.782	3.950	10	0		EHAERM
CC(C)[C@H]1CCC[C@@](CNC(=O)OCc2ccccc2)(C(=O)[O-])C1	ZINC000725244338	563975740	/nfs/dbraw/zinc/97/57/40/563975740.db2.gz	HOUWTTRUZUGJAP-QFBILLFUSA-N	-1	0	333.428	3.830	10	0		EHAERM
O=C([O-])[C@H](CNC(=O)OCc1ccccc1)CC1CCCCCC1	ZINC000725246892	563976175	/nfs/dbraw/zinc/97/61/75/563976175.db2.gz	ZYXODXBSYBPSIO-KRWDZBQOSA-N	-1	0	333.428	3.974	10	0		EHAERM
CCN(C(=O)Nc1cc(C(=O)[O-])ccc1Br)C1CCC1	ZINC000706801989	954957591	/nfs/dbraw/zinc/95/75/91/954957591.db2.gz	AQJNIUUCLBXVNQ-UHFFFAOYSA-N	-1	0	341.205	3.554	10	0		EHAERM
CCN(C(=O)Nc1cccc(OCc2ccccc2)c1)[C@H](C)C(=O)[O-]	ZINC000707946213	954984371	/nfs/dbraw/zinc/98/43/71/954984371.db2.gz	CRSLCZFULARWRH-CQSZACIVSA-N	-1	0	342.395	3.593	10	0		EHAERM
O=C([O-])c1ccc(OCc2cnoc2C2CC2)c(Br)c1	ZINC000700797673	976976114	/nfs/dbraw/zinc/97/61/14/976976114.db2.gz	UWRCBDZPCXTTMO-UHFFFAOYSA-N	-1	0	338.157	3.592	10	0		EHAERM
O=C([O-])c1coc(CN2CCCc3cc(Br)ccc32)c1	ZINC000713324473	977632754	/nfs/dbraw/zinc/63/27/54/977632754.db2.gz	MTJWFHLPVKTSKU-UHFFFAOYSA-N	-1	0	336.185	3.693	10	0		EHAERM
O=C([O-])c1csc(CN2CCc3ccc(Br)cc32)c1	ZINC000713327403	977632789	/nfs/dbraw/zinc/63/27/89/977632789.db2.gz	INSIZFSHXKEMRW-UHFFFAOYSA-N	-1	0	338.226	3.772	10	0		EHAERM
COc1ccc([C@@H]2C[C@@H](C)N(C(=O)c3ccc(F)cc3[O-])C2)cc1	ZINC000123877170	1038092865	/nfs/dbraw/zinc/09/28/65/1038092865.db2.gz	FUYJVWMDRUAEIG-TZMCWYRMSA-N	-1	0	329.371	3.558	10	0		EHAERM
O=C(c1nn(-c2ccccc2F)cc1[O-])N1CCC[C@H]2CCCC[C@H]21	ZINC000333617006	1138311757	/nfs/dbraw/zinc/31/17/57/1138311757.db2.gz	XTZFNDJILRGFOW-UKRRQHHQSA-N	-1	0	343.402	3.512	10	0		EHAERM
CCC[C@@H](Nc1nc(C)nc2sc3c(c21)CC[C@@H](C)C3)C(=O)[O-]	ZINC000058279793	214524630	/nfs/dbraw/zinc/52/46/30/214524630.db2.gz	HXUUUFHMCUXPAH-BXKDBHETSA-N	-1	0	333.457	3.790	10	0		EHAERM
Cc1ccccc1[C@](O[C@H]1CCCCN1C)(C(=O)[O-])c1ccccc1	ZINC000098089782	219083335	/nfs/dbraw/zinc/08/33/35/219083335.db2.gz	SSDWPUFYQALBIE-FPOVZHCZSA-N	-1	0	339.435	3.782	10	0		EHAERM
CCOC(=O)c1c(C)c(CCC(=O)[O-])n(Cc2ccccc2C)c1C	ZINC000049455123	214009552	/nfs/dbraw/zinc/00/95/52/214009552.db2.gz	YPUZILHPMRGPIW-UHFFFAOYSA-N	-1	0	343.423	3.656	10	0		EHAERM
CC(C)n1c2ccccc2c2c1C(=O)N(CC(=O)[O-])[C@@H]2c1ccccc1	ZINC000049453493	214009556	/nfs/dbraw/zinc/00/95/56/214009556.db2.gz	MIUOOCMNHZLIHH-LJQANCHMSA-N	-1	0	348.402	3.852	10	0		EHAERM
O=C(C=C([O-])c1cc(-c2ccccc2)on1)c1cc(F)ccc1O	ZINC000100754696	219105698	/nfs/dbraw/zinc/10/56/98/219105698.db2.gz	KTNNIFSHKDXDGD-UHFFFAOYSA-N	-1	0	325.295	3.642	10	0		EHAERM
O=C([O-])c1ccc(NC(=O)c2sccc2Br)s1	ZINC000104300164	219371676	/nfs/dbraw/zinc/37/16/76/219371676.db2.gz	NQXUKDQFRZKNJB-UHFFFAOYSA-N	-1	0	332.200	3.523	10	0		EHAERM
CC(C)Cn1cc(C(=O)[O-])c(-c2ccc(Br)s2)n1	ZINC000038002162	213187652	/nfs/dbraw/zinc/18/76/52/213187652.db2.gz	GKFHRHDHLFBRBM-UHFFFAOYSA-N	-1	0	329.219	3.728	10	0		EHAERM
O=C([O-])[C@@H](Cc1cccs1)Cc1ccccc1Br	ZINC000037528806	213154428	/nfs/dbraw/zinc/15/44/28/213154428.db2.gz	AQOUQDCROAUHMC-LLVKDONJSA-N	-1	0	325.227	3.997	10	0		EHAERM
CCc1c(C)nc(-c2cccnc2)nc1Oc1ccc(C(=O)[O-])cc1	ZINC000073682646	216412117	/nfs/dbraw/zinc/41/21/17/216412117.db2.gz	GTZRPRKRBOTHQP-UHFFFAOYSA-N	-1	0	335.363	3.900	10	0		EHAERM
O=C([O-])c1ccc(Oc2ccc(I)cc2)cc1	ZINC000021989522	212268819	/nfs/dbraw/zinc/26/88/19/212268819.db2.gz	MRSFBOVGCCIXLS-UHFFFAOYSA-N	-1	0	340.116	3.782	10	0		EHAERM
CCc1ccccc1NC(=O)N1CCc2ccccc2[C@H]1CC(=O)[O-]	ZINC000021044458	212203415	/nfs/dbraw/zinc/20/34/15/212203415.db2.gz	BPCGRCRUMNBAFZ-GOSISDBHSA-N	-1	0	338.407	3.855	10	0		EHAERM
Cc1sc2nc(C)nc(Nc3ccc(O)c(C(=O)[O-])c3)c2c1C	ZINC000020326644	212119193	/nfs/dbraw/zinc/11/91/93/212119193.db2.gz	DQJQNMSJWHYVTR-UHFFFAOYSA-N	-1	0	329.381	3.764	10	0		EHAERM
CCN1c2ccccc2S/C(=C/c2ccc(C(=O)[O-])cc2)C1=O	ZINC000049453047	132430243	/nfs/dbraw/zinc/43/02/43/132430243.db2.gz	ATSPSHRKXAFGFU-LFIBNONCSA-N	-1	0	325.389	3.885	10	0		EHAERM
O=C([O-])Cn1c(COc2cccc3ccccc32)nc2ccccc21	ZINC000057351697	527640598	/nfs/dbraw/zinc/64/05/98/527640598.db2.gz	NWOYVZZCWYZRSV-UHFFFAOYSA-N	-1	0	332.359	3.853	10	0		EHAERM
CC1(C)CCC[C@](CNC(=O)OCc2ccccc2)(C(=O)[O-])CC1	ZINC000725244855	563975857	/nfs/dbraw/zinc/97/58/57/563975857.db2.gz	NGXCAFSZCDDVLP-IBGZPJMESA-N	-1	0	333.428	3.974	10	0		EHAERM
C[C@H]1C[C@@H](NC(=O)OCc2ccccc2)c2c1c(F)ccc2C(=O)[O-]	ZINC000536959930	564091788	/nfs/dbraw/zinc/09/17/88/564091788.db2.gz	LWSAVCBZWQWLEV-XHDPSFHLSA-N	-1	0	343.354	3.999	10	0		EHAERM
CC(C)(C)c1[nH]sc(=NC(=O)OCc2ccccc2)c1C(=O)[O-]	ZINC000675075631	564113190	/nfs/dbraw/zinc/11/31/90/564113190.db2.gz	CEDWSSFOGQEEII-UHFFFAOYSA-N	-1	0	334.397	3.888	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1NC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21	ZINC000694351547	976692122	/nfs/dbraw/zinc/69/21/22/976692122.db2.gz	WFGCPUKBVIEPAM-UISBYWKRSA-N	-1	0	338.201	3.522	10	0		EHAERM
CCCc1cc(C(=O)N(CC(=O)[O-])Cc2ccccc2)sc1C	ZINC000701314187	977004534	/nfs/dbraw/zinc/00/45/34/977004534.db2.gz	XOGHDSNJDPYYDM-UHFFFAOYSA-N	-1	0	331.437	3.736	10	0		EHAERM
C[N@H+](Cc1cc(Br)cs1)Cc1cc(C(=O)[O-])cs1	ZINC000711378251	977538732	/nfs/dbraw/zinc/53/87/32/977538732.db2.gz	OPYYKODNMHFDIV-UHFFFAOYSA-N	-1	0	346.271	3.902	10	0		EHAERM
O=C([O-])[C@H]1C[C@@H](c2ccccc2)CN(C(=O)c2coc3ccccc23)C1	ZINC000180303655	1031878317	/nfs/dbraw/zinc/87/83/17/1031878317.db2.gz	NCFAGUIMGCMQQL-CVEARBPZSA-N	-1	0	349.386	3.763	10	0		EHAERM
Cc1cc(COc2ccc(Br)cc2C)oc1C(=O)[O-]	ZINC000063061359	214742816	/nfs/dbraw/zinc/74/28/16/214742816.db2.gz	CILJZZJLTTXHRF-UHFFFAOYSA-N	-1	0	325.158	3.936	10	0		EHAERM
CCc1c(CC)n2ncc(C(=O)[O-])c2nc1-c1ccc(Cl)cc1	ZINC000098179826	219086711	/nfs/dbraw/zinc/08/67/11/219086711.db2.gz	HUNTXCAUDHZWTC-UHFFFAOYSA-N	-1	0	329.787	3.873	10	0		EHAERM
CCn1c2ccccc2c2c1C(=O)N(CC(=O)[O-])[C@@H]2c1cccc(C)c1	ZINC000049453487	214009431	/nfs/dbraw/zinc/00/94/31/214009431.db2.gz	DAXAFKNXZHEEFU-LJQANCHMSA-N	-1	0	348.402	3.599	10	0		EHAERM
C[C@H](Nc1ncc(Br)cc1C(=O)[O-])C1CCCCC1	ZINC000104179787	219355964	/nfs/dbraw/zinc/35/59/64/219355964.db2.gz	QAHRAGDMOWZWIH-VIFPVBQESA-N	-1	0	327.222	3.923	10	0		EHAERM
COc1ccc([C@H](Nc2ccccc2)C(=O)[O-])cc1Br	ZINC000038052401	213198639	/nfs/dbraw/zinc/19/86/39/213198639.db2.gz	SFPNAKKMODPUIQ-AWEZNQCLSA-N	-1	0	336.185	3.696	10	0		EHAERM
O=C([O-])c1nnn(Cc2c(F)cccc2F)c1-c1cccc(Cl)c1	ZINC000070457082	215694982	/nfs/dbraw/zinc/69/49/82/215694982.db2.gz	BKHLAVCWVQWYCU-UHFFFAOYSA-N	-1	0	349.724	3.623	10	0		EHAERM
Cc1cc2c(nc(-c3cccnc3)nc2N[C@H](C(=O)[O-])C(C)C)s1	ZINC000072260823	216086172	/nfs/dbraw/zinc/08/61/72/216086172.db2.gz	IMUYWCGZNDUOGH-ZDUSSCGKSA-N	-1	0	342.424	3.583	10	0		EHAERM
Cc1sc(NC(=O)COc2cccc(C)c2C)c(C(=O)[O-])c1C	ZINC000020332796	212119652	/nfs/dbraw/zinc/11/96/52/212119652.db2.gz	BFUIOIMVVLYNDR-UHFFFAOYSA-N	-1	0	333.409	3.697	10	0		EHAERM
O=C([O-])c1cc(-c2cccnc2)nc2cc(Br)ccc21	ZINC000019478953	212031367	/nfs/dbraw/zinc/03/13/67/212031367.db2.gz	YTWNCRZBRNKICG-UHFFFAOYSA-N	-1	0	329.153	3.758	10	0		EHAERM
CC[C@H](Nc1ncnc2scc(-c3ccc(OC)cc3)c21)C(=O)[O-]	ZINC000082584442	217487583	/nfs/dbraw/zinc/48/75/83/217487583.db2.gz	SSTNAKFZZSJJKU-ZDUSSCGKSA-N	-1	0	343.408	3.642	10	0		EHAERM
Cc1nn2c(nc(C)cc2SCC(=O)[O-])c1-c1ccc(Cl)cc1	ZINC000005137880	210398286	/nfs/dbraw/zinc/39/82/86/210398286.db2.gz	CUYNWEWARBTNTM-UHFFFAOYSA-N	-1	0	347.827	3.843	10	0		EHAERM
CCc1nc(-c2cccc(F)c2)nc(N2CCCC[C@H]2C(=O)[O-])c1C	ZINC000073679300	135620212	/nfs/dbraw/zinc/62/02/12/135620212.db2.gz	OXCYGJNUNFAJGD-INIZCTEOSA-N	-1	0	343.402	3.597	10	0		EHAERM
CC(C)[C@@H]1CCC[C@@](CNC(=O)OCc2ccccc2)(C(=O)[O-])C1	ZINC000725244339	563975751	/nfs/dbraw/zinc/97/57/51/563975751.db2.gz	HOUWTTRUZUGJAP-VQIMIIECSA-N	-1	0	333.428	3.830	10	0		EHAERM
CC(C)(C)[C@H]1CCCC[C@]1(NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000226769109	564118264	/nfs/dbraw/zinc/11/82/64/564118264.db2.gz	ZEHMJQJVAHUPOO-DNVCBOLYSA-N	-1	0	333.428	3.973	10	0		EHAERM
O=C([O-])c1ccc(Br)c(NC(=O)[C@@H]2CCC[C@@H]3C[C@@H]32)c1	ZINC000694341271	954775407	/nfs/dbraw/zinc/77/54/07/954775407.db2.gz	AQQFNMSFNLGSBE-IEBDPFPHSA-N	-1	0	338.201	3.522	10	0		EHAERM
CCN(C(=O)Nc1cccc(OCc2ccccc2)c1)[C@@H](C)C(=O)[O-]	ZINC000707946212	954984402	/nfs/dbraw/zinc/98/44/02/954984402.db2.gz	CRSLCZFULARWRH-AWEZNQCLSA-N	-1	0	342.395	3.593	10	0		EHAERM
Cc1cc(NCc2ncc(Br)s2)ccc1C(=O)[O-]	ZINC000714950646	955109683	/nfs/dbraw/zinc/10/96/83/955109683.db2.gz	JZUVWZSHSCGCOZ-UHFFFAOYSA-N	-1	0	327.203	3.524	10	0		EHAERM
Cc1oc(C(=O)[O-])cc1C(=O)Nc1cc(C)cc(Br)c1	ZINC000689116460	976227381	/nfs/dbraw/zinc/22/73/81/976227381.db2.gz	HLZUIIPLPQNZAA-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
O=C([O-])CN(Cc1coc(-c2cccc(F)c2)n1)Cc1ccccc1	ZINC000692477709	976503191	/nfs/dbraw/zinc/50/31/91/976503191.db2.gz	YXQMKQPGSYWIPO-UHFFFAOYSA-N	-1	0	340.354	3.568	10	0		EHAERM
Cc1ccc(C([O-])=CC(=O)c2cc(Br)ccc2O)cc1	ZINC000100754703	219105796	/nfs/dbraw/zinc/10/57/96/219105796.db2.gz	OJHWFUBEZHAUPE-UHFFFAOYSA-N	-1	0	333.181	3.919	10	0		EHAERM
Cc1cc(Cl)ccc1NC(=O)COc1ccc(/C=C/C(=O)[O-])cc1	ZINC000004227843	210148541	/nfs/dbraw/zinc/14/85/41/210148541.db2.gz	RNDDEGGMEOPGLC-RUDMXATFSA-N	-1	0	345.782	3.764	10	0		EHAERM
O=C([O-])[C@H](NCC(F)(F)F)c1ccc(SC(F)(F)F)cc1	ZINC000037973168	213177498	/nfs/dbraw/zinc/17/74/98/213177498.db2.gz	NVQOKFYAMNDHPB-MRVPVSSYSA-N	-1	0	333.253	3.576	10	0		EHAERM
O=C([O-])[C@@H](Cc1ccccc1)SCc1ccc(Br)o1	ZINC000037527774	213154543	/nfs/dbraw/zinc/15/45/43/213154543.db2.gz	MMSSIXQXLBJJKF-GFCCVEGCSA-N	-1	0	341.226	3.971	10	0		EHAERM
O=C([O-])CCSCC(=O)Nc1cc(Cl)c(Cl)cc1Cl	ZINC000037382014	213142584	/nfs/dbraw/zinc/14/25/84/213142584.db2.gz	VWKILWLRJPYRRQ-UHFFFAOYSA-N	-1	0	342.631	3.793	10	0		EHAERM
O=C([O-])c1nnn(Cc2cccc(C(F)(F)F)c2)c1-c1ccccc1	ZINC000070456954	215694849	/nfs/dbraw/zinc/69/48/49/215694849.db2.gz	YYEDZHVXXURDCV-UHFFFAOYSA-N	-1	0	347.296	3.710	10	0		EHAERM
O=C([O-])Cc1cn(-c2ccc(O)cc2)nc1-c1ccc(Cl)cc1	ZINC000071331061	215762391	/nfs/dbraw/zinc/76/23/91/215762391.db2.gz	ODEJIHCIOCAUGG-UHFFFAOYSA-N	-1	0	328.755	3.525	10	0		EHAERM
Cc1cccc(-c2cc(OCC(=O)[O-])nc(-c3ccc(F)cc3)n2)c1	ZINC000073696662	216412802	/nfs/dbraw/zinc/41/28/02/216412802.db2.gz	OYRRQZHVEZDTBU-UHFFFAOYSA-N	-1	0	338.338	3.722	10	0		EHAERM
CC(C)(C)C1CC(=C([O-])C(F)(F)F)C(O)=C(C(=O)C(F)(F)F)C1	ZINC000199789710	241039729	/nfs/dbraw/zinc/03/97/29/241039729.db2.gz	SXXAGMRKHAMBDV-YUMQZZPRSA-N	-1	0	346.267	3.507	10	0		EHAERM
COc1ccc(Cl)cc1/C=C/C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000021022724	212201206	/nfs/dbraw/zinc/20/12/06/212201206.db2.gz	KHVPSDMHZUXMIC-RUDMXATFSA-N	-1	0	331.755	3.699	10	0		EHAERM
Cc1ccc(-c2csc3nc(C)n(CCC(=O)[O-])c(=O)c23)cc1C	ZINC000019954669	212089254	/nfs/dbraw/zinc/08/92/54/212089254.db2.gz	SPZCBZNRRSXKQR-UHFFFAOYSA-N	-1	0	342.420	3.525	10	0		EHAERM
O=C([O-])c1nnn(-c2cccc(Cl)c2)c1CSc1ccccc1	ZINC000011730715	211242166	/nfs/dbraw/zinc/24/21/66/211242166.db2.gz	GPIOJVRAHQBULO-UHFFFAOYSA-N	-1	0	345.811	3.911	10	0		EHAERM
C[C@@H]1CC(C)(C)C[C@@](CNC(=O)OCc2ccccc2)(C(=O)[O-])C1	ZINC000725245537	563975994	/nfs/dbraw/zinc/97/59/94/563975994.db2.gz	VGDWOUHBBFESSO-KUHUBIRLSA-N	-1	0	333.428	3.830	10	0		EHAERM
CC1=CCC[C@H](C)[C@@H]1C[C@H](CNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000725245809	563976106	/nfs/dbraw/zinc/97/61/06/563976106.db2.gz	IEZHDBAGFIAKNW-CGTJXYLNSA-N	-1	0	345.439	3.996	10	0		EHAERM
COc1cccc2c1N(C(=O)OC(C)(C)C)[C@@H](C)C[C@@H]2CC(=O)[O-]	ZINC000725253640	563982179	/nfs/dbraw/zinc/98/21/79/563982179.db2.gz	CHHWYIJJOZAFBE-NWDGAFQWSA-N	-1	0	335.400	3.787	10	0		EHAERM
CCCCN(CC)c1ncc(NC(=O)c2ccccc2)cc1C(=O)[O-]	ZINC000064978691	564098857	/nfs/dbraw/zinc/09/88/57/564098857.db2.gz	TWLDNHHROJZJLV-UHFFFAOYSA-N	-1	0	341.411	3.659	10	0		EHAERM
CC(C)[C@H]1CC[C@@H](C)C[C@]1(NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000299873231	564118262	/nfs/dbraw/zinc/11/82/62/564118262.db2.gz	QDPBBDIEAIDFSL-IDHHARJASA-N	-1	0	333.428	3.828	10	0		EHAERM
O=C([O-])c1ccc(CN2CCc3c2cccc3Br)cc1	ZINC000713307798	969074261	/nfs/dbraw/zinc/07/42/61/969074261.db2.gz	BGXRLOGAEXABGZ-UHFFFAOYSA-N	-1	0	332.197	3.710	10	0		EHAERM
Cc1nc(COc2ccc(Br)cc2C(=O)[O-])c(C)s1	ZINC000692532734	976525704	/nfs/dbraw/zinc/52/57/04/976525704.db2.gz	QLHAXBWAHFVPHF-UHFFFAOYSA-N	-1	0	342.214	3.800	10	0		EHAERM
Cc1csc(C(=O)[O-])c1NC(=O)c1ccsc1Br	ZINC000698696373	976900324	/nfs/dbraw/zinc/90/03/24/976900324.db2.gz	LITHSCJEBSTHLS-UHFFFAOYSA-N	-1	0	346.227	3.831	10	0		EHAERM
O=C([O-])c1cccc(CNc2ncc(Cl)cc2Br)c1	ZINC000707049555	977374635	/nfs/dbraw/zinc/37/46/35/977374635.db2.gz	KRZUVVWXWNCSIQ-UHFFFAOYSA-N	-1	0	341.592	3.808	10	0		EHAERM
CN(Cc1ccc(C(=O)[O-])s1)Cc1cscc1Br	ZINC000709871367	977472880	/nfs/dbraw/zinc/47/28/80/977472880.db2.gz	VFOKSLMKGQARNQ-UHFFFAOYSA-N	-1	0	346.271	3.902	10	0		EHAERM
Cc1cc(C(=O)[O-])oc1C(=O)Nc1ccc(C)cc1Br	ZINC000717245414	977884083	/nfs/dbraw/zinc/88/40/83/977884083.db2.gz	KMOIONWZOPWOII-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
C[C@H](NC(=O)[C@@H]1CCC[C@@H](C(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000245671822	1030198929	/nfs/dbraw/zinc/19/89/29/1030198929.db2.gz	HMAIPVNCEPAHLT-CYZMBNFOSA-N	-1	0	343.345	3.774	10	0		EHAERM
CC(C)(C)OC(=O)N1CCC[C@@]2(C[C@H](CC(=O)[O-])c3ccccc32)C1	ZINC000051943347	214109946	/nfs/dbraw/zinc/10/99/46/214109946.db2.gz	NOYSNFSVSDDBJL-VBKZILBWSA-N	-1	0	345.439	3.917	10	0		EHAERM
C[C@@H](C(=O)[O-])N(C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl	ZINC000054054109	214212925	/nfs/dbraw/zinc/21/29/25/214212925.db2.gz	UDHIFDZDOXMPSP-YFKPBYRVSA-N	-1	0	325.579	3.584	10	0		EHAERM
CCO[C@@H](CCOc1cc(Cl)c(Cl)cc1Cl)C(=O)[O-]	ZINC000062760857	214730793	/nfs/dbraw/zinc/73/07/93/214730793.db2.gz	BMIJUEYNSOJYNK-JTQLQIEISA-N	-1	0	327.591	3.905	10	0		EHAERM
COc1ccc(-n2nc(C)c3c2CCc2cc(C(=O)[O-])sc2-3)cc1	ZINC000049454713	214009282	/nfs/dbraw/zinc/00/92/82/214009282.db2.gz	UBCONXBISFQITA-UHFFFAOYSA-N	-1	0	340.404	3.715	10	0		EHAERM
Cc1ccc2c(c1)c1c(n2C)C(=O)N([C@@H](C)C(=O)[O-])[C@H]1c1ccccc1	ZINC000049453484	214008440	/nfs/dbraw/zinc/00/84/40/214008440.db2.gz	AKNQTRCMLLHIEI-UGSOOPFHSA-N	-1	0	348.402	3.505	10	0		EHAERM
Cc1nn2c(nc(C)cc2SCC(=O)[O-])c1-c1cc(C)ccc1C	ZINC000049453332	214007890	/nfs/dbraw/zinc/00/78/90/214007890.db2.gz	DQFLAKXIWBZXAG-UHFFFAOYSA-N	-1	0	341.436	3.807	10	0		EHAERM
O=C([O-])c1cccc(Nc2c3c([nH+]c4ccc(C(=O)[O-])cc42)CCC3)c1	ZINC000004226664	210146437	/nfs/dbraw/zinc/14/64/37/210146437.db2.gz	KJZFHFVHUBDUIB-UHFFFAOYSA-N	-1	0	348.358	3.864	10	0		EHAERM
CC(C)(C)OC(=O)N[C@H](Cc1c(Cl)cccc1Cl)C(=O)[O-]	ZINC000066114360	215014033	/nfs/dbraw/zinc/01/40/33/215014033.db2.gz	YBKLZYRUNSCPAT-LLVKDONJSA-N	-1	0	334.199	3.514	10	0		EHAERM
CCN(CCC(=O)[O-])C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002386077	209846315	/nfs/dbraw/zinc/84/63/15/209846315.db2.gz	AREQXKGLQHHFSL-UHFFFAOYSA-N	-1	0	339.391	3.732	10	0		EHAERM
C[C@@H]1[C@@H](C)CCC[C@@H]1Nc1ncc(Br)cc1C(=O)[O-]	ZINC000104184473	219357430	/nfs/dbraw/zinc/35/74/30/219357430.db2.gz	KDBUUMZFTDUYCA-SBMIAAHKSA-N	-1	0	327.222	3.779	10	0		EHAERM
Cc1cccc(-c2c(C(=O)[O-])nnn2-c2ccccc2C(F)(F)F)c1	ZINC000070456874	215694579	/nfs/dbraw/zinc/69/45/79/215694579.db2.gz	IRMSTQKUPGXBEG-UHFFFAOYSA-N	-1	0	347.296	3.960	10	0		EHAERM
CCc1ccccc1N(C)C(=O)Cc1c2ccccc2[nH]c1C(=O)[O-]	ZINC000000201576	209481126	/nfs/dbraw/zinc/48/11/26/209481126.db2.gz	VDDRWXQGNCPKGG-UHFFFAOYSA-N	-1	0	336.391	3.634	10	0		EHAERM
Cc1ccc2c(c1)c(CC(=O)Nc1ccccc1F)c(C(=O)[O-])n2C	ZINC000004821770	210287959	/nfs/dbraw/zinc/28/79/59/210287959.db2.gz	HNHKIBWTHGUHIW-UHFFFAOYSA-N	-1	0	340.354	3.505	10	0		EHAERM
CCc1nc(-c2ccc(F)cc2)nc(N2CCCC[C@H]2C(=O)[O-])c1C	ZINC000073679756	135620122	/nfs/dbraw/zinc/62/01/22/135620122.db2.gz	SNGCTDXWNJPPIZ-INIZCTEOSA-N	-1	0	343.402	3.597	10	0		EHAERM
O=C([O-])c1ccccc1-c1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000000045065	563213234	/nfs/dbraw/zinc/21/32/34/563213234.db2.gz	FTYSOVVFLXCEMR-UHFFFAOYSA-N	-1	0	343.338	3.852	10	0		EHAERM
CC(C)c1ccc2c(c1)N(C(=O)OCc1ccccc1)[C@H](C(=O)[O-])C2	ZINC000584881821	563879739	/nfs/dbraw/zinc/87/97/39/563879739.db2.gz	BYNSGMVGWFDGHR-SFHVURJKSA-N	-1	0	339.391	3.963	10	0		EHAERM
O=C([O-])c1cn(Cc2ccccc2)c2cc(Cl)c(F)cc2c1=O	ZINC000039276035	563922549	/nfs/dbraw/zinc/92/25/49/563922549.db2.gz	WZWFUSKOYHUXNG-UHFFFAOYSA-N	-1	0	331.730	3.541	10	0		EHAERM
O=C([O-])c1csc(-n2nc(-c3ccccc3)cc2C(F)(F)F)n1	ZINC000005243299	564031854	/nfs/dbraw/zinc/03/18/54/564031854.db2.gz	JOIBUOSJONQSSB-UHFFFAOYSA-N	-1	0	339.298	3.713	10	0		EHAERM
Cc1cc(C(=O)[O-])nc2cc(Br)cc(Br)c12	ZINC000667363395	564079304	/nfs/dbraw/zinc/07/93/04/564079304.db2.gz	PMABNEHGTNZWJR-UHFFFAOYSA-N	-1	0	344.990	3.766	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OCCOCC2CCCC2)c1	ZINC000700750351	976968265	/nfs/dbraw/zinc/96/82/65/976968265.db2.gz	JQYCEVXAKBDJDA-UHFFFAOYSA-N	-1	0	343.217	3.733	10	0		EHAERM
Cc1cc(C(=O)Nc2ccc(Br)c(C)c2)oc1C(=O)[O-]	ZINC000707509769	977397041	/nfs/dbraw/zinc/39/70/41/977397041.db2.gz	SUEHMMUCKSZBQJ-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
CN1CC[C@@H](CNC(=O)c2cc(F)c([O-])c(Cl)c2)c2ccccc21	ZINC000194475683	1028518113	/nfs/dbraw/zinc/51/81/13/1028518113.db2.gz	PMSIERCRPVSZAB-NSHDSACASA-N	-1	0	348.805	3.538	10	0		EHAERM
CC(C)c1ccc(-n2cc([O-])c(C(=O)N3CC[C@@H]4CCC[C@H]43)n2)cc1	ZINC000330251115	1042555130	/nfs/dbraw/zinc/55/51/30/1042555130.db2.gz	NGLACAQLWJHLIH-DOTOQJQBSA-N	-1	0	339.439	3.716	10	0		EHAERM
Cc1ccc(CNc2ncc(Br)cc2C(=O)[O-])s1	ZINC000050226734	214050682	/nfs/dbraw/zinc/05/06/82/214050682.db2.gz	HTEYMLKOSADWRI-UHFFFAOYSA-N	-1	0	327.203	3.524	10	0		EHAERM
CCOc1cc(C(=O)[O-])cc(Br)c1OC[C@@H](C)CC	ZINC000050424836	214056451	/nfs/dbraw/zinc/05/64/51/214056451.db2.gz	FGEDYIBBWHDHCX-VIFPVBQESA-N	-1	0	331.206	3.971	10	0		EHAERM
O=C([O-])c1ncccc1COc1ccc(Cl)cc1Br	ZINC000062760417	214731032	/nfs/dbraw/zinc/73/10/32/214731032.db2.gz	YTTNJFNJPCXXIH-UHFFFAOYSA-N	-1	0	342.576	3.775	10	0		EHAERM
Cc1ccc(CSc2nc3ccncc3n2[C@H](C)C(=O)[O-])cc1	ZINC000049454623	214009533	/nfs/dbraw/zinc/00/95/33/214009533.db2.gz	JIJDQTKYEUGSSZ-GFCCVEGCSA-N	-1	0	327.409	3.678	10	0		EHAERM
Cc1cc(Br)cc(C)c1OCc1ccc(C(=O)[O-])o1	ZINC000004227038	210146816	/nfs/dbraw/zinc/14/68/16/210146816.db2.gz	MWODFHKMKNOAEZ-UHFFFAOYSA-N	-1	0	325.158	3.936	10	0		EHAERM
Cc1c(C(=O)[O-])sc2nc(-c3cccc(Br)c3)cn12	ZINC000040438160	213304380	/nfs/dbraw/zinc/30/43/80/213304380.db2.gz	SEMMWHXATMPIKV-UHFFFAOYSA-N	-1	0	337.198	3.832	10	0		EHAERM
O=C([O-])[C@@H](NCC(F)(F)F)c1ccc(SC(F)(F)F)cc1	ZINC000037973167	213177733	/nfs/dbraw/zinc/17/77/33/213177733.db2.gz	NVQOKFYAMNDHPB-QMMMGPOBSA-N	-1	0	333.253	3.576	10	0		EHAERM
CC(C)c1cc(N2CCC[C@H](C(=O)[O-])C2)nc(-c2cccc(F)c2)n1	ZINC000070452323	215692816	/nfs/dbraw/zinc/69/28/16/215692816.db2.gz	AQDXCJBPQODICI-AWEZNQCLSA-N	-1	0	343.402	3.707	10	0		EHAERM
CC(C)N(Cc1nc(C(=O)[O-])co1)Cc1cccc(C(F)(F)F)c1	ZINC000036052212	213058130	/nfs/dbraw/zinc/05/81/30/213058130.db2.gz	ICJSHEFQXYKDRZ-UHFFFAOYSA-N	-1	0	342.317	3.802	10	0		EHAERM
Cc1ccc(-c2csc3ncnc(N(C)CCC(=O)[O-])c23)c(C)c1	ZINC000020317983	212118782	/nfs/dbraw/zinc/11/87/82/212118782.db2.gz	DDFPMXROJLBXQX-UHFFFAOYSA-N	-1	0	341.436	3.886	10	0		EHAERM
Cc1c(F)c(Br)ccc1NC(=O)[C@H](C(=O)[O-])C(C)(C)C	ZINC000694014631	954772533	/nfs/dbraw/zinc/77/25/33/954772533.db2.gz	CDYKAHYKFRSBFK-SNVBAGLBSA-N	-1	0	346.196	3.582	10	0		EHAERM
O=C([O-])c1coc(C(=O)Nc2cccc(Br)c2Cl)c1	ZINC000690895123	976340858	/nfs/dbraw/zinc/34/08/58/976340858.db2.gz	YKQPMSSQWZGDFV-UHFFFAOYSA-N	-1	0	344.548	3.646	10	0		EHAERM
C[C@H]1CCc2c(C(=O)N(CC(=O)[O-])Cc3ccccc3)csc2C1	ZINC000692405401	976446762	/nfs/dbraw/zinc/44/67/62/976446762.db2.gz	TZZMDWHETRQIHA-ZDUSSCGKSA-N	-1	0	343.448	3.600	10	0		EHAERM
Cc1nc(COc2cc(Br)cc(C(=O)[O-])c2)c(C)s1	ZINC000700732108	976966662	/nfs/dbraw/zinc/96/66/62/976966662.db2.gz	XOOQGSDQZPTNIT-UHFFFAOYSA-N	-1	0	342.214	3.800	10	0		EHAERM
CC(C)C[C@H](C)C(=O)Nc1ccc(Br)c(C(=O)[O-])c1	ZINC000704611912	977239929	/nfs/dbraw/zinc/23/99/29/977239929.db2.gz	QLTNRMOBTNKOLL-VIFPVBQESA-N	-1	0	328.206	3.768	10	0		EHAERM
C[C@H](NC(=O)[C@H]1CCC[C@H](C(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000179954677	1016889072	/nfs/dbraw/zinc/88/90/72/1016889072.db2.gz	HMAIPVNCEPAHLT-DRZSPHRISA-N	-1	0	343.345	3.774	10	0		EHAERM
Cc1cccc2c1OCC[C@@H]2NC(=O)c1cc(F)c([O-])c(Cl)c1	ZINC000192641295	1036518227	/nfs/dbraw/zinc/51/82/27/1036518227.db2.gz	OHGZQPLFOWTONT-AWEZNQCLSA-N	-1	0	335.762	3.747	10	0		EHAERM
O=C(N[C@H]1CCOC2(CCC2)C1)c1ccc(Cl)c(Cl)c1[O-]	ZINC000269012714	1128735983	/nfs/dbraw/zinc/73/59/83/1128735983.db2.gz	BRAHQEZHHBACLV-VIFPVBQESA-N	-1	0	330.211	3.531	10	0		EHAERM
Cc1nc([C@@H]2CCCN2C(=O)c2ccc3[n-]c(=S)oc3c2)cs1	ZINC000190011059	1140378963	/nfs/dbraw/zinc/37/89/63/1140378963.db2.gz	IWERGPJTOKHEKE-ZDUSSCGKSA-N	-1	0	345.449	3.859	10	0		EHAERM
Cc1ccc2c(c1)c1c(n2C)C(=O)N([C@H](C)C(=O)[O-])[C@@H]1c1ccccc1	ZINC000049453485	214008599	/nfs/dbraw/zinc/00/85/99/214008599.db2.gz	AKNQTRCMLLHIEI-FZKQIMNGSA-N	-1	0	348.402	3.505	10	0		EHAERM
COc1cccc2c(C(=O)[O-])cc(-c3cccc(OC)c3OC)nc12	ZINC000004227726	210148045	/nfs/dbraw/zinc/14/80/45/210148045.db2.gz	BTXKQHSAMJPVNS-UHFFFAOYSA-N	-1	0	339.347	3.626	10	0		EHAERM
COc1ccc2c(c1)c(CC(=O)[O-])c(C)n2C(=O)/C=C/c1ccccc1	ZINC000004212527	210145332	/nfs/dbraw/zinc/14/53/32/210145332.db2.gz	NKPPORKKCMYYTO-DHZHZOJOSA-N	-1	0	349.386	3.939	10	0	in-man	EHAERM
O=C([O-])[C@H](NC(=O)c1c(Cl)cccc1Cl)C1CCCCC1	ZINC000038036179	213194762	/nfs/dbraw/zinc/19/47/62/213194762.db2.gz	GDWLSHGOXMASCN-CYBMUJFWSA-N	-1	0	330.211	3.757	10	0		EHAERM
O=C([O-])[C@@H](NC(=O)c1c(Cl)cccc1Cl)C1CCCCC1	ZINC000038036178	213193637	/nfs/dbraw/zinc/19/36/37/213193637.db2.gz	GDWLSHGOXMASCN-ZDUSSCGKSA-N	-1	0	330.211	3.757	10	0		EHAERM
Nc1cc(C(=O)[O-])ccc1Nc1cc(Br)ccc1F	ZINC000037931006	213175004	/nfs/dbraw/zinc/17/50/04/213175004.db2.gz	OCDQCQAKYNEKFN-UHFFFAOYSA-N	-1	0	325.137	3.612	10	0		EHAERM
O=C([O-])[C@H](Cc1cccs1)Cc1ccccc1Br	ZINC000037528805	213154625	/nfs/dbraw/zinc/15/46/25/213154625.db2.gz	AQOUQDCROAUHMC-NSHDSACASA-N	-1	0	325.227	3.997	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1NC(=O)C1CCCCC1	ZINC000037742267	213164021	/nfs/dbraw/zinc/16/40/21/213164021.db2.gz	CAMOPVRKERFWBR-UHFFFAOYSA-N	-1	0	326.190	3.666	10	0		EHAERM
O=C([O-])c1c(-c2ccccc2)csc1NC(=O)CN1CCCCC1	ZINC000020342571	212121013	/nfs/dbraw/zinc/12/10/13/212121013.db2.gz	PXDAELYHTQRWIX-UHFFFAOYSA-N	-1	0	344.436	3.538	10	0		EHAERM
O=C([O-])c1c(NC(=O)COc2ccccc2)sc2c1CCCCC2	ZINC000020334879	212120613	/nfs/dbraw/zinc/12/06/13/212120613.db2.gz	AYBLEGNRTATAIZ-UHFFFAOYSA-N	-1	0	345.420	3.733	10	0		EHAERM
CCc1cc2c(nc(C)nc2Nc2ccc(C(=O)[O-])c(O)c2)s1	ZINC000020326704	212119940	/nfs/dbraw/zinc/11/99/40/212119940.db2.gz	PBRDENDBBBDGFH-UHFFFAOYSA-N	-1	0	329.381	3.710	10	0		EHAERM
O=C([O-])c1nc(Nc2ccc(Br)cc2)ccc1Cl	ZINC000019965959	212090805	/nfs/dbraw/zinc/09/08/05/212090805.db2.gz	LMXDBEBPTXGGJH-UHFFFAOYSA-N	-1	0	327.565	3.939	10	0		EHAERM
Cc1sc2[nH]c(SCCC(=O)[O-])nc(=O)c2c1-c1ccccc1	ZINC000019954604	212089565	/nfs/dbraw/zinc/08/95/65/212089565.db2.gz	SFXYMXPIMZJCHL-UHFFFAOYSA-N	-1	0	346.433	3.527	10	0		EHAERM
O=C([O-])c1ccccc1OCc1cc(F)ccc1Br	ZINC000019478984	212030684	/nfs/dbraw/zinc/03/06/84/212030684.db2.gz	AQPUNLNGWQVTSF-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
O=C([O-])[C@H]1CCC(=O)N(c2ccccc2)[C@H]1c1ccc(Cl)cc1	ZINC000049452857	132430810	/nfs/dbraw/zinc/43/08/10/132430810.db2.gz	SXUBJRJCRQCMES-RDJZCZTQSA-N	-1	0	329.783	3.909	10	0		EHAERM
O=C([O-])CC[C@@H]1Cc2ccccc2N(C(=O)OCc2ccccc2)C1	ZINC000669380092	564084350	/nfs/dbraw/zinc/08/43/50/564084350.db2.gz	ILFOKKXJJSZPDY-MRXNPFEDSA-N	-1	0	339.391	3.867	10	0		EHAERM
Cc1ccc(/C=C2\Sc3ccccc3N(CC(=O)[O-])C2=O)cc1	ZINC000020665415	564141762	/nfs/dbraw/zinc/14/17/62/564141762.db2.gz	XMXDQZSZHQRCLC-YBEGLDIGSA-N	-1	0	325.389	3.559	10	0		EHAERM
Cc1sc([C@H]2CCCN2C(=O)OCc2ccccc2)nc1C(=O)[O-]	ZINC000685949158	564177043	/nfs/dbraw/zinc/17/70/43/564177043.db2.gz	KQXOIJVRMCHNGY-CYBMUJFWSA-N	-1	0	346.408	3.623	10	0		EHAERM
Cc1ccc2c(c1)C(=O)N(c1ccc3cc(C(=O)[O-])ccc3c1)C2=O	ZINC000058863681	564177723	/nfs/dbraw/zinc/17/77/23/564177723.db2.gz	SMEYGWIQFZGKRJ-UHFFFAOYSA-N	-1	0	331.327	3.647	10	0		EHAERM
CCN(C(=O)Nc1ccccc1OCc1ccccc1)[C@H](C)C(=O)[O-]	ZINC000707948869	954986404	/nfs/dbraw/zinc/98/64/04/954986404.db2.gz	NEBSXSPFYXXNBY-CQSZACIVSA-N	-1	0	342.395	3.593	10	0		EHAERM
CC(C)c1nsc(Oc2cc(Br)cc(C(=O)[O-])c2)n1	ZINC000700732442	976966877	/nfs/dbraw/zinc/96/68/77/976966877.db2.gz	JRRIKRDZILLSAL-UHFFFAOYSA-N	-1	0	343.202	3.915	10	0		EHAERM
CN(Cc1cscc1Br)[C@@H](C(=O)[O-])c1ccccc1	ZINC000709867444	977471711	/nfs/dbraw/zinc/47/17/11/977471711.db2.gz	CRXHMJSVKNLXKN-CYBMUJFWSA-N	-1	0	340.242	3.768	10	0		EHAERM
CC1(C)CCC[C@H](COc2cc(Br)cc(C(=O)[O-])c2)O1	ZINC000714381031	977669836	/nfs/dbraw/zinc/66/98/36/977669836.db2.gz	KRJAMWLAKXPSKE-GFCCVEGCSA-N	-1	0	343.217	3.874	10	0		EHAERM
C[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(Br)c(C(=O)[O-])c1	ZINC000714401684	977671638	/nfs/dbraw/zinc/67/16/38/977671638.db2.gz	KQGASPQURPZBIZ-ONGXEEELSA-N	-1	0	340.217	3.912	10	0		EHAERM
C[C@H](NC(=O)[C@@H]1CCC[C@H](C(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000179954648	1016887927	/nfs/dbraw/zinc/88/79/27/1016887927.db2.gz	HMAIPVNCEPAHLT-UHTWSYAYSA-N	-1	0	343.345	3.774	10	0		EHAERM
O=C(c1cc(F)c([O-])c(F)c1)N1CC=C(c2ccccc2F)CC1	ZINC000137348489	1028309774	/nfs/dbraw/zinc/30/97/74/1028309774.db2.gz	RBAAARQVNOMSBI-UHFFFAOYSA-N	-1	0	333.309	3.739	10	0		EHAERM
Cc1nc2cc([N-]S(=O)(=O)c3cc(F)ccc3Cl)ccc2o1	ZINC000103057987	1036815852	/nfs/dbraw/zinc/81/58/52/1036815852.db2.gz	RYPIBUCFTPYSGP-UHFFFAOYSA-N	-1	0	340.763	3.730	10	0		EHAERM
CC[C@H](C)CS(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1Cl	ZINC000050425772	214056864	/nfs/dbraw/zinc/05/68/64/214056864.db2.gz	UWSWDZXGRHWYQM-ZETCQYMHSA-N	-1	0	325.213	3.511	10	0		EHAERM
CCCn1c(SCc2ccc(C(=O)[O-])cc2)nc2cccnc21	ZINC000049454108	214009559	/nfs/dbraw/zinc/00/95/59/214009559.db2.gz	KCAVLEIDUNXQQR-UHFFFAOYSA-N	-1	0	327.409	3.832	10	0		EHAERM
Cc1cccc(Nc2ncnc(Nc3ccc(C(=O)[O-])cc3)c2N)c1C	ZINC000040755280	213382688	/nfs/dbraw/zinc/38/26/88/213382688.db2.gz	HSWRGGPVRZDHBL-UHFFFAOYSA-N	-1	0	349.394	3.861	10	0		EHAERM
Cc1noc(C)c1Cc1nc(-c2ccccc2)c(CC(=O)[O-])s1	ZINC000040680298	213368150	/nfs/dbraw/zinc/36/81/50/213368150.db2.gz	ZUIGFMYAQXXGIH-UHFFFAOYSA-N	-1	0	328.393	3.633	10	0		EHAERM
CCOc1ccc(-n2nnc(C(=O)[O-])c2-c2cccc(Cl)c2)cc1	ZINC000070456804	215694750	/nfs/dbraw/zinc/69/47/50/215694750.db2.gz	JTZOAPYHGHBLPZ-UHFFFAOYSA-N	-1	0	343.770	3.685	10	0		EHAERM
CCCCCN(CCCCC)S(=O)(=O)c1ccc(C(=O)[O-])cc1	ZINC000033877197	212967804	/nfs/dbraw/zinc/96/78/04/212967804.db2.gz	YJHBQZUBRNHJFV-UHFFFAOYSA-N	-1	0	341.473	3.756	10	0		EHAERM
Cc1cc([O-])c(-c2ccnc(Nc3ccc(Cl)cc3)n2)c(=O)o1	ZINC000072443557	216236861	/nfs/dbraw/zinc/23/68/61/216236861.db2.gz	FUIPAVCTRAUWSY-UHFFFAOYSA-N	-1	0	329.743	3.508	10	0		EHAERM
Cc1cc(C)c(Nc2nc(OCC(=O)[O-])cc(C(C)(C)C)n2)c(C)c1	ZINC000073697529	216413013	/nfs/dbraw/zinc/41/30/13/216413013.db2.gz	QJDZMMAGQVFBAB-UHFFFAOYSA-N	-1	0	343.427	3.906	10	0		EHAERM
CN(CCC(=O)[O-])c1ncnc2sc3c(c21)CC[C@H](C(C)(C)C)C3	ZINC000020317957	212118592	/nfs/dbraw/zinc/11/85/92/212118592.db2.gz	WJEPFJXCVNSCCU-NSHDSACASA-N	-1	0	347.484	3.753	10	0		EHAERM
C[C@H]1CC(C)(C)C[C@@](CNC(=O)OCc2ccccc2)(C(=O)[O-])C1	ZINC000725245539	563976030	/nfs/dbraw/zinc/97/60/30/563976030.db2.gz	VGDWOUHBBFESSO-LIRRHRJNSA-N	-1	0	333.428	3.830	10	0		EHAERM
CC1(C)C(C)(C)C1(C(=O)[O-])C(=O)Nc1cccc(Br)c1	ZINC000688603926	954633113	/nfs/dbraw/zinc/63/31/13/954633113.db2.gz	YJJYVSURCJJWKC-UHFFFAOYSA-N	-1	0	340.217	3.525	10	0		EHAERM
O=C([O-])Cc1ccccc1COc1c(F)cccc1Br	ZINC000706876640	977365638	/nfs/dbraw/zinc/36/56/38/977365638.db2.gz	KJQISSZORZOCGO-UHFFFAOYSA-N	-1	0	339.160	3.794	10	0		EHAERM
O=C([O-])c1csc(COc2cc(Cl)ccc2Br)n1	ZINC000708102846	977415471	/nfs/dbraw/zinc/41/54/71/977415471.db2.gz	SNFDMIOGHMIRNQ-UHFFFAOYSA-N	-1	0	348.605	3.836	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OCC[C@@H]2C[C@H]2C2CC2)c1	ZINC000715456540	977757580	/nfs/dbraw/zinc/75/75/80/977757580.db2.gz	TZHMTTCMKMNNET-YGRLFVJLSA-N	-1	0	325.202	3.962	10	0		EHAERM
CC[C@@H](C(=O)[O-])[C@@](C)(O)c1cc2cc(Br)ccc2o1	ZINC000052260553	214124847	/nfs/dbraw/zinc/12/48/47/214124847.db2.gz	VHCLMANNLZVNCO-IINYFYTJSA-N	-1	0	327.174	3.514	10	0		EHAERM
C[C@@H](Nc1ncnc2sc3c(c21)CC[C@@H](C(C)(C)C)C3)C(=O)[O-]	ZINC000058279506	214525226	/nfs/dbraw/zinc/52/52/26/214525226.db2.gz	BPISMUVMPWBOQD-NXEZZACHSA-N	-1	0	333.457	3.727	10	0		EHAERM
Cc1cc(-c2cc(C)c3nnc(C(=O)[O-])c(O)c3c2)ccc1Cl	ZINC000098180363	219086429	/nfs/dbraw/zinc/08/64/29/219086429.db2.gz	BXYXFLPECVNVSG-UHFFFAOYSA-N	-1	0	328.755	3.559	10	0		EHAERM
O=C([O-])C[C@@H]1CCCCN1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000038026788	213192698	/nfs/dbraw/zinc/19/26/98/213192698.db2.gz	IMHFCBAXTYBNPG-JTQLQIEISA-N	-1	0	331.199	3.855	10	0		EHAERM
CCCc1cc(Oc2ccc(C(=O)[O-])cc2)nc(-c2cccnc2)n1	ZINC000073682635	216411653	/nfs/dbraw/zinc/41/16/53/216411653.db2.gz	XCMSHMKRPVGZHU-UHFFFAOYSA-N	-1	0	335.363	3.982	10	0		EHAERM
CCc1cc(C(=O)[O-])c(NC(=O)COc2ccccc2Cl)s1	ZINC000020333291	212120876	/nfs/dbraw/zinc/12/08/76/212120876.db2.gz	NVGAPSSSPBANQC-UHFFFAOYSA-N	-1	0	339.800	3.680	10	0		EHAERM
Cc1ccc(-c2csc3[nH]c(SCCC(=O)[O-])nc(=O)c23)cc1	ZINC000019954600	212089216	/nfs/dbraw/zinc/08/92/16/212089216.db2.gz	HFZSZUCGTZBXTF-UHFFFAOYSA-N	-1	0	346.433	3.527	10	0		EHAERM
O=C([O-])c1cnc(Oc2ccccc2Br)c(Cl)c1	ZINC000019429963	212026870	/nfs/dbraw/zinc/02/68/70/212026870.db2.gz	VUNBUTMGSOAYNA-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
Cc1ccc(-n2nc(C(=O)[O-])nc2-c2ccccc2Cl)c(C)c1	ZINC000045921388	258003547	/nfs/dbraw/zinc/00/35/47/258003547.db2.gz	CLVFKOIEBVNWQJ-UHFFFAOYSA-N	-1	0	327.771	3.903	10	0		EHAERM
Cc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C(=O)[O-])c(Cl)c1	ZINC000409422230	563962037	/nfs/dbraw/zinc/96/20/37/563962037.db2.gz	CWCVWYQXUQWCRI-CHWSQXEVSA-N	-1	0	339.819	3.684	10	0		EHAERM
C[C@@H]1CCCC[C@@H]1C[C@H](CNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000725246868	563976117	/nfs/dbraw/zinc/97/61/17/563976117.db2.gz	ZLQFDVMJXGSMOV-DJIMGWMZSA-N	-1	0	333.428	3.830	10	0		EHAERM
O=C([O-])[C@H]1[C@H](c2ccccc2)CCCN1C(=O)OCc1ccccc1	ZINC000725262396	563985841	/nfs/dbraw/zinc/98/58/41/563985841.db2.gz	VRCLCIGJFXSJBZ-ZWKOTPCHSA-N	-1	0	339.391	3.656	10	0		EHAERM
C[C@H]1C[C@H](c2ccc(C(=O)[O-])cc2)CN1C(=O)OCc1ccccc1	ZINC000536959752	564091790	/nfs/dbraw/zinc/09/17/90/564091790.db2.gz	SSIXLCPGBPIJEO-KSSFIOAISA-N	-1	0	339.391	3.899	10	0		EHAERM
O=Cc1ccc(Br)cc1OCc1ccc(C(=O)[O-])cc1	ZINC000691391706	954683684	/nfs/dbraw/zinc/68/36/84/954683684.db2.gz	QEMGYKWZFLTYEA-UHFFFAOYSA-N	-1	0	335.153	3.539	10	0		EHAERM
CC(F)(F)C1(C(=O)Nc2cc(C(=O)[O-])ccc2Br)CC1	ZINC000710268902	955023782	/nfs/dbraw/zinc/02/37/82/955023782.db2.gz	NZDJWWPRJOBKRK-UHFFFAOYSA-N	-1	0	348.143	3.521	10	0		EHAERM
O=C([O-])c1ccc(CN2CCc3ccc(Br)cc32)s1	ZINC000713324096	977633187	/nfs/dbraw/zinc/63/31/87/977633187.db2.gz	IEEGKRQGVJECMN-UHFFFAOYSA-N	-1	0	338.226	3.772	10	0		EHAERM
C[C@H]1CCCC[C@@H]1C(=O)Nc1cc(Br)ccc1C(=O)[O-]	ZINC000714401952	977671453	/nfs/dbraw/zinc/67/14/53/977671453.db2.gz	PFSIMVRAJRQOMV-ONGXEEELSA-N	-1	0	340.217	3.912	10	0		EHAERM
Cc1c(Br)cncc1NCc1cc(C(=O)[O-])cs1	ZINC000722728508	978165514	/nfs/dbraw/zinc/16/55/14/978165514.db2.gz	SYPMHDSPLSIORA-UHFFFAOYSA-N	-1	0	327.203	3.524	10	0		EHAERM
C[C@@H]1C[C@H](C(=O)[N-]S(=O)(=O)c2sccc2Cl)CC(C)(C)C1	ZINC000408497776	1019660579	/nfs/dbraw/zinc/66/05/79/1019660579.db2.gz	MDACOPGREFBGPJ-ZJUUUORDSA-N	-1	0	349.905	3.669	10	0		EHAERM
C[C@@H]1CN(C(=O)c2c([O-])c(Cl)cc(Cl)c2Cl)CCCO1	ZINC000171209761	1030746185	/nfs/dbraw/zinc/74/61/85/1030746185.db2.gz	LWMPZRQOSDNZLE-SSDOTTSWSA-N	-1	0	338.618	3.603	10	0		EHAERM
O=C([O-])[C@H]1C[C@@H](c2ccccc2)CN(C(=O)c2ccc(Cl)s2)C1	ZINC000180333451	1031881268	/nfs/dbraw/zinc/88/12/68/1031881268.db2.gz	GIWVZGSIPKOSCV-OLZOCXBDSA-N	-1	0	349.839	3.732	10	0		EHAERM
CCc1ccc(C(=O)N2CCC(c3nc(C)cs3)CC2)c(O)c1	ZINC000190880994	1036286483	/nfs/dbraw/zinc/28/64/83/1036286483.db2.gz	LZJDQHXRURZCFX-UHFFFAOYSA-N	-1	0	330.453	3.739	10	0		EHAERM
Cc1nn(CCCC(=O)[O-])c(=O)c2c3cc(C(C)C)ccc3sc21	ZINC000049453723	214009482	/nfs/dbraw/zinc/00/94/82/214009482.db2.gz	GISXFLXIOOBPSU-UHFFFAOYSA-N	-1	0	344.436	3.908	10	0		EHAERM
CC[C@@H](C(=O)[O-])n1c2cnccc2nc1SCc1cccc(F)c1	ZINC000049454620	214009337	/nfs/dbraw/zinc/00/93/37/214009337.db2.gz	YUVJBGHBWZQZLB-AWEZNQCLSA-N	-1	0	345.399	3.898	10	0		EHAERM
CCCn1c2cnccc2nc1SCc1ccc(C(=O)[O-])cc1	ZINC000049453437	214008072	/nfs/dbraw/zinc/00/80/72/214008072.db2.gz	BDZUCEOXYKFUFV-UHFFFAOYSA-N	-1	0	327.409	3.832	10	0		EHAERM
O=C([O-])Cc1c(Cl)nc(-c2ccccc2)n1Cc1ccccc1	ZINC000003651687	210072028	/nfs/dbraw/zinc/07/20/28/210072028.db2.gz	OZRLINSKTFKPDY-UHFFFAOYSA-N	-1	0	326.783	3.879	10	0		EHAERM
Cc1ccc(Nc2ncnc(Nc3ccc(C(=O)[O-])cc3)c2N)cc1C	ZINC000040703065	213371919	/nfs/dbraw/zinc/37/19/19/213371919.db2.gz	IEFJJEFASHEGPL-UHFFFAOYSA-N	-1	0	349.394	3.861	10	0		EHAERM
O=C([O-])c1cccc(N2CCN(c3ccc(-n4cccc4)cc3)C2=O)c1	ZINC000038929279	213230653	/nfs/dbraw/zinc/23/06/53/213230653.db2.gz	XOTRGXXVEMNQAE-UHFFFAOYSA-N	-1	0	347.374	3.622	10	0		EHAERM
O=C([O-])c1ccc([S@@](=O)Cc2ccc(Br)s2)cc1	ZINC000037923137	213173307	/nfs/dbraw/zinc/17/33/07/213173307.db2.gz	ZUWUKMIZFSSZOY-GOSISDBHSA-N	-1	0	345.239	3.517	10	0		EHAERM
O=C([O-])c1cc(-c2cccnc2)nc2cccc(Br)c21	ZINC000022165782	212280703	/nfs/dbraw/zinc/28/07/03/212280703.db2.gz	MXHOZXLUMMRXPC-UHFFFAOYSA-N	-1	0	329.153	3.758	10	0		EHAERM
O=C([O-])c1cc(-c2ccncc2)nc2cccc(Br)c21	ZINC000022175855	212279853	/nfs/dbraw/zinc/27/98/53/212279853.db2.gz	BSZCJTJUGQLRCC-UHFFFAOYSA-N	-1	0	329.153	3.758	10	0		EHAERM
CC(C)(C)OC(=O)N[C@@H](CCc1cc(Cl)ccc1Cl)C(=O)[O-]	ZINC000095749218	218447607	/nfs/dbraw/zinc/44/76/07/218447607.db2.gz	FHXAYHHHENQHGB-LBPRGKRZSA-N	-1	0	348.226	3.904	10	0		EHAERM
CC(C)(C)OC(=O)N[C@@H](CCc1ccc(Cl)c(Cl)c1)C(=O)[O-]	ZINC000095749225	218447629	/nfs/dbraw/zinc/44/76/29/218447629.db2.gz	OZYGDHXYNPZNGL-LBPRGKRZSA-N	-1	0	348.226	3.904	10	0		EHAERM
CC(C)(C)OC(=O)N([C@H](C(=O)[O-])c1ccc(Cl)cc1)C1CC1	ZINC000226797079	564117314	/nfs/dbraw/zinc/11/73/14/564117314.db2.gz	MNTLXRHONXZOBO-ZDUSSCGKSA-N	-1	0	325.792	3.865	10	0		EHAERM
C[C@H](c1ccc(C(=O)[O-])o1)N(C)Cc1cscc1Br	ZINC000709871246	977472554	/nfs/dbraw/zinc/47/25/54/977472554.db2.gz	SKQNPSINHWLCBZ-MRVPVSSYSA-N	-1	0	344.230	3.995	10	0		EHAERM
O=C([N-]S(=O)(=O)c1cccc2ccccc21)[C@@H]1CC12CCCCC2	ZINC000408490154	1019649526	/nfs/dbraw/zinc/64/95/26/1019649526.db2.gz	ZCNINIOMIZPUOJ-INIZCTEOSA-N	-1	0	343.448	3.615	10	0		EHAERM
Cc1cc(C(=O)N2C[C@@H](c3ccccc3)C[C@H](C(=O)[O-])C2)sc1C	ZINC000180313522	1031877061	/nfs/dbraw/zinc/87/70/61/1031877061.db2.gz	NGIUOTORIGWYRU-HOTGVXAUSA-N	-1	0	343.448	3.695	10	0		EHAERM
CO[C@@H](C)c1cccc(NS(=O)(=O)c2ccc3c(c2)C[C@H](C)O3)c1	ZINC000106007648	1037292674	/nfs/dbraw/zinc/29/26/74/1037292674.db2.gz	QTNNMTXEVQUGOY-STQMWFEESA-N	-1	0	347.436	3.518	10	0		EHAERM
O=C([O-])c1c(-c2ccc(F)cc2)nc2ccc(Br)cn21	ZINC000097758495	219054534	/nfs/dbraw/zinc/05/45/34/219054534.db2.gz	VSKUDEANWWGRES-UHFFFAOYSA-N	-1	0	335.132	3.601	10	0		EHAERM
Cc1cc(Br)ccc1O[C@@H](CC(=O)[O-])C(F)(F)F	ZINC000063062795	214743054	/nfs/dbraw/zinc/74/30/54/214743054.db2.gz	HBXXBODNYTYKAJ-VIFPVBQESA-N	-1	0	327.096	3.542	10	0		EHAERM
O=C([O-])c1nn(Cc2ccc(Br)cc2)c2ccccc21	ZINC000003629078	210068787	/nfs/dbraw/zinc/06/87/87/210068787.db2.gz	LHUBCIXMWFXTQH-UHFFFAOYSA-N	-1	0	331.169	3.545	10	0		EHAERM
Cc1ccc(Nc2ncc(Br)cc2C(=O)[O-])cc1F	ZINC000104175806	219355729	/nfs/dbraw/zinc/35/57/29/219355729.db2.gz	IUKPETGINDZSKX-UHFFFAOYSA-N	-1	0	325.137	3.733	10	0		EHAERM
O=C([O-])Cc1csc2nc(-c3ccc(Br)s3)cn12	ZINC000038002314	213187620	/nfs/dbraw/zinc/18/76/20/213187620.db2.gz	LKWZQAWVDDGSRO-UHFFFAOYSA-N	-1	0	343.227	3.514	10	0		EHAERM
Cc1nn(-c2ccc(Br)cc2)c2sc(C(=O)[O-])cc12	ZINC000036905360	213126488	/nfs/dbraw/zinc/12/64/88/213126488.db2.gz	UUBZPSOXQZNEAL-UHFFFAOYSA-N	-1	0	337.198	3.856	10	0		EHAERM
CCc1ccccc1NC(=O)N1CCc2ccccc2[C@@H]1CC(=O)[O-]	ZINC000021044453	212202343	/nfs/dbraw/zinc/20/23/43/212202343.db2.gz	BPCGRCRUMNBAFZ-SFHVURJKSA-N	-1	0	338.407	3.855	10	0		EHAERM
O=C([O-])c1ccc(Nc2ncnc3sc4c(c32)CCCC4)cc1O	ZINC000020326248	212119884	/nfs/dbraw/zinc/11/98/84/212119884.db2.gz	FEZQVIPYKNTXBC-UHFFFAOYSA-N	-1	0	341.392	3.718	10	0		EHAERM
O=C([O-])c1nnn(-c2ccccc2Cl)c1CSc1ccccc1	ZINC000011759137	211245146	/nfs/dbraw/zinc/24/51/46/211245146.db2.gz	MTWBIRNULXUCPU-UHFFFAOYSA-N	-1	0	345.811	3.911	10	0		EHAERM
Cc1cccc(-c2c(C(=O)[O-])nnn2-c2cccc(C(F)(F)F)c2)c1	ZINC000011759645	211244974	/nfs/dbraw/zinc/24/49/74/211244974.db2.gz	VYLONVZPXNTDDN-UHFFFAOYSA-N	-1	0	347.296	3.960	10	0		EHAERM
Cc1ccc(-n2nnc(C(=O)[O-])c2CSc2ccccc2)cc1	ZINC000011730482	211242106	/nfs/dbraw/zinc/24/21/06/211242106.db2.gz	BMMPNPRBYNYBPH-UHFFFAOYSA-N	-1	0	325.393	3.566	10	0		EHAERM
CCc1c(C(=O)[O-])nnn1-c1cc2c(cc1C)noc2-c1ccccc1	ZINC000011730363	211242192	/nfs/dbraw/zinc/24/21/92/211242192.db2.gz	DZDAQCDIJNAGHB-UHFFFAOYSA-N	-1	0	348.362	3.645	10	0		EHAERM
CCC(CC)c1cc(C(=O)N[C@@H](CCC(=O)[O-])c2ccccc2)on1	ZINC000139474730	521631698	/nfs/dbraw/zinc/63/16/98/521631698.db2.gz	MKKUMKMZIIJCIO-HNNXBMFYSA-N	-1	0	344.411	3.914	10	0		EHAERM
O=C([O-])c1ccc2cc(CCNC(=O)OCc3ccccc3)oc2c1	ZINC000685950779	564177054	/nfs/dbraw/zinc/17/70/54/564177054.db2.gz	ZAQBLUUIGBSINY-UHFFFAOYSA-N	-1	0	339.347	3.600	10	0		EHAERM
COC[C@]1(C(=O)[O-])CCCCN1Cc1cc(Cl)sc1Cl	ZINC000692385675	976443190	/nfs/dbraw/zinc/44/31/90/976443190.db2.gz	CCNRJRYJNJWXMR-ZDUSSCGKSA-N	-1	0	338.256	3.511	10	0		EHAERM
Cc1c(F)c(Br)ccc1NCc1ccoc1C(=O)[O-]	ZINC000694027725	976663844	/nfs/dbraw/zinc/66/38/44/976663844.db2.gz	LVDXYLWATUTFBS-UHFFFAOYSA-N	-1	0	328.137	3.800	10	0		EHAERM
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(Br)cc1C(=O)[O-]	ZINC000714402258	977671457	/nfs/dbraw/zinc/67/14/57/977671457.db2.gz	SOBZNDHYOCYILC-MWLCHTKSSA-N	-1	0	340.217	3.912	10	0		EHAERM
Cc1cc(C(=O)N2C[C@H](C(=O)[O-])C[C@H](c3ccccc3)C2)sc1C	ZINC000180313557	1031877033	/nfs/dbraw/zinc/87/70/33/1031877033.db2.gz	NGIUOTORIGWYRU-JKSUJKDBSA-N	-1	0	343.448	3.695	10	0		EHAERM
O=C([O-])[C@@H]1C[C@H](c2ccccc2)CN(C(=O)c2cc3ccccc3o2)C1	ZINC000180308999	1031877359	/nfs/dbraw/zinc/87/73/59/1031877359.db2.gz	RUXKOGIQHQEHRA-DLBZAZTESA-N	-1	0	349.386	3.763	10	0		EHAERM
CC(C)(C)OC(=O)N[C@H](Cc1cccc(Cl)c1Cl)C(=O)[O-]	ZINC000066114356	215014012	/nfs/dbraw/zinc/01/40/12/215014012.db2.gz	NMXTYWWEDGNCRZ-SNVBAGLBSA-N	-1	0	334.199	3.514	10	0		EHAERM
O=C([O-])C[C@H]1CCCCN1C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000038026751	213192983	/nfs/dbraw/zinc/19/29/83/213192983.db2.gz	GPMLHOIXXNQUQO-SNVBAGLBSA-N	-1	0	331.199	3.855	10	0		EHAERM
Nc1cc(C(=O)[O-])ccc1Nc1ccc(Br)cc1F	ZINC000037930353	213174828	/nfs/dbraw/zinc/17/48/28/213174828.db2.gz	UJSSVECQEBARGV-UHFFFAOYSA-N	-1	0	325.137	3.612	10	0		EHAERM
O=C([O-])c1ccccc1Oc1ccccc1I	ZINC000035454636	213028205	/nfs/dbraw/zinc/02/82/05/213028205.db2.gz	WJERLGCBEMSENP-UHFFFAOYSA-N	-1	0	340.116	3.782	10	0		EHAERM
O=C([O-])c1cc(Nc2ncnc3sc4c(c32)CCCC4)ccc1O	ZINC000020326229	212119546	/nfs/dbraw/zinc/11/95/46/212119546.db2.gz	FNIIZVGDVBNRLC-UHFFFAOYSA-N	-1	0	341.392	3.718	10	0		EHAERM
O=C([O-])c1cccc(OCc2cc(F)ccc2Br)c1	ZINC000019803148	212070419	/nfs/dbraw/zinc/07/04/19/212070419.db2.gz	FHVJNDWGZJGWBQ-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
O=C([O-])c1cnc2c(cccc2C(F)(F)F)c1NCc1cccnc1	ZINC000019793842	212068826	/nfs/dbraw/zinc/06/88/26/212068826.db2.gz	IUVIBMNSYAHRTB-UHFFFAOYSA-N	-1	0	347.296	3.959	10	0		EHAERM
O=C([O-])C1CCC2(CC1)CCN(C(=O)OCc1ccccc1)CC2	ZINC000584880323	563878885	/nfs/dbraw/zinc/87/88/85/563878885.db2.gz	QLYJZZMBAYRHIU-UHFFFAOYSA-N	-1	0	331.412	3.680	10	0		EHAERM
C[C@@H]1Cc2c(sc(I)c2C(=O)[O-])[C@@H](C)C1	ZINC000725246759	563976166	/nfs/dbraw/zinc/97/61/66/563976166.db2.gz	VXFZXGGJCCCYPC-WDSKDSINSA-N	-1	0	336.194	3.737	10	0		EHAERM
C[C@@H]1CCC[C@H](C[C@H](CNC(=O)OCc2ccccc2)C(=O)[O-])C1	ZINC000725245193	563975904	/nfs/dbraw/zinc/97/59/04/563975904.db2.gz	BHGKNLZLPURLFA-HYVNUMGLSA-N	-1	0	333.428	3.830	10	0		EHAERM
CC(C)(C)OC(=O)N([C@@H](C(=O)[O-])c1ccc(Cl)cc1)C1CC1	ZINC000226797074	564117331	/nfs/dbraw/zinc/11/73/31/564117331.db2.gz	MNTLXRHONXZOBO-CYBMUJFWSA-N	-1	0	325.792	3.865	10	0		EHAERM
CC1CCC(NC(=O)c2cc(Cl)sc2Cl)(C(=O)[O-])CC1	ZINC000223857274	939043276	/nfs/dbraw/zinc/04/32/76/939043276.db2.gz	ISAMRYSTNMHLIW-UHFFFAOYSA-N	-1	0	336.240	3.818	10	0		EHAERM
CCN(C(=O)Nc1ccc(OCc2ccccc2)cc1)[C@H](C)C(=O)[O-]	ZINC000707951203	969030150	/nfs/dbraw/zinc/03/01/50/969030150.db2.gz	ZBVCHNKNKYWMMH-CQSZACIVSA-N	-1	0	342.395	3.593	10	0		EHAERM
CCN(Cc1ccoc1)Cc1ccc(C(=O)[O-])cc1Br	ZINC000688454316	976177881	/nfs/dbraw/zinc/17/78/81/976177881.db2.gz	PZUGCSBPNLWROP-UHFFFAOYSA-N	-1	0	338.201	3.762	10	0		EHAERM
Cc1c(F)c(Br)ccc1NCc1ccc(C(=O)[O-])o1	ZINC000694028806	976663656	/nfs/dbraw/zinc/66/36/56/976663656.db2.gz	RJTMXRVZXPBVAW-UHFFFAOYSA-N	-1	0	328.137	3.800	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OC/C(Cl)=C\Cl)c1	ZINC000700715587	976965394	/nfs/dbraw/zinc/96/53/94/976965394.db2.gz	COPVCOVNKUIFBJ-XBXARRHUSA-N	-1	0	325.973	3.845	10	0		EHAERM
O=C([O-])c1cc(COc2c(F)cccc2Br)cs1	ZINC000707066836	977374789	/nfs/dbraw/zinc/37/47/89/977374789.db2.gz	ZHAVJCSEDWZFKZ-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
Cc1nc(COc2ccc(C(=O)[O-])cc2Br)c(C)s1	ZINC000707959049	977407234	/nfs/dbraw/zinc/40/72/34/977407234.db2.gz	DWRQQMPSXVETNO-UHFFFAOYSA-N	-1	0	342.214	3.800	10	0		EHAERM
C[C@H](NC(=O)C1CCC(C(=O)[O-])CC1)c1ccc(C(F)(F)F)cc1	ZINC000194389079	1024409504	/nfs/dbraw/zinc/40/95/04/1024409504.db2.gz	JBPCLRLIIMXXDP-PKSQDBQZSA-N	-1	0	343.345	3.774	10	0		EHAERM
CC(C)(C)OC(=O)N1CCC[C@@]2(C[C@@H](CC(=O)[O-])c3ccccc32)C1	ZINC000051943352	214110507	/nfs/dbraw/zinc/11/05/07/214110507.db2.gz	NOYSNFSVSDDBJL-JLTOFOAXSA-N	-1	0	345.439	3.917	10	0		EHAERM
CNc1nc(Nc2ccc(C(=O)[O-])cc2OC2CCC2)ncc1Cl	ZINC000098180853	219086836	/nfs/dbraw/zinc/08/68/36/219086836.db2.gz	KJOVOWVZFUHNBF-UHFFFAOYSA-N	-1	0	348.790	3.545	10	0		EHAERM
Cc1ccccc1CSc1nc2ccncc2n1[C@@H](C)C(=O)[O-]	ZINC000049454617	214009167	/nfs/dbraw/zinc/00/91/67/214009167.db2.gz	WWOGEHOKAKGJQO-LBPRGKRZSA-N	-1	0	327.409	3.678	10	0		EHAERM
CC(C)(C)[C@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)[O-])CC1	ZINC000103234885	219273817	/nfs/dbraw/zinc/27/38/17/219273817.db2.gz	SYWRPZFKQKXPIE-IXDOHACOSA-N	-1	0	331.456	3.651	10	0	in-vitro	EHAERM
O=C([O-])c1sccc1OCc1cc(F)ccc1Br	ZINC000104070905	219345056	/nfs/dbraw/zinc/34/50/56/219345056.db2.gz	DQXWXVGXQZWFEE-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
O=C([O-])[C@H](Cc1cccs1)Cc1ccc(Br)cc1	ZINC000037528383	213154269	/nfs/dbraw/zinc/15/42/69/213154269.db2.gz	ZYFUDNIVSKJANQ-NSHDSACASA-N	-1	0	325.227	3.997	10	0		EHAERM
CC(C)(C)OC(=O)N[C@H](Cc1cccc(-c2ccccc2)c1)C(=O)[O-]	ZINC000035569524	213038968	/nfs/dbraw/zinc/03/89/68/213038968.db2.gz	JMEFJZPUOYOJOM-QGZVFWFLSA-N	-1	0	341.407	3.874	10	0		EHAERM
O=C([O-])CCSCC(=O)Nc1c(Cl)cc(Cl)cc1Cl	ZINC000037405233	213145086	/nfs/dbraw/zinc/14/50/86/213145086.db2.gz	DOWSPGOMLKPHBO-UHFFFAOYSA-N	-1	0	342.631	3.793	10	0		EHAERM
COCC(=O)Nc1scc(-c2ccc3c(c2)CCCC3)c1C(=O)[O-]	ZINC000020335805	212120867	/nfs/dbraw/zinc/12/08/67/212120867.db2.gz	ULEOPUHFJRBIGD-UHFFFAOYSA-N	-1	0	345.420	3.577	10	0		EHAERM
C[C@@H]1CCc2c(sc(NC(=O)COc3ccccc3)c2C(=O)[O-])C1	ZINC000020333709	212120573	/nfs/dbraw/zinc/12/05/73/212120573.db2.gz	XICZNOPRXKYFMZ-LLVKDONJSA-N	-1	0	345.420	3.589	10	0		EHAERM
Cc1cc(C(=O)[O-])c(NC(=O)c2cccc(Br)c2)s1	ZINC000020332932	212120702	/nfs/dbraw/zinc/12/07/02/212120702.db2.gz	WYRNRFACLGLVCP-UHFFFAOYSA-N	-1	0	340.198	3.770	10	0		EHAERM
Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1CCC(=O)[O-]	ZINC000019954665	212089284	/nfs/dbraw/zinc/08/92/84/212089284.db2.gz	USQSIZXQSYZFDL-UHFFFAOYSA-N	-1	0	348.811	3.562	10	0		EHAERM
CCc1ccc(-n2nnc(C(=O)[O-])c2CSc2ccccc2)cc1	ZINC000011730516	211241641	/nfs/dbraw/zinc/24/16/41/211241641.db2.gz	IYFCUTSRQQVAIQ-UHFFFAOYSA-N	-1	0	339.420	3.820	10	0		EHAERM
Cc1sc2nc(Cc3ccccc3)nc(N[C@@H](C)C(=O)[O-])c2c1C	ZINC000008548678	210963816	/nfs/dbraw/zinc/96/38/16/210963816.db2.gz	PWMOGMHQTKNBRE-NSHDSACASA-N	-1	0	341.436	3.784	10	0		EHAERM
CC[C@]1(C(=O)[O-])C[C@H](C2CC2)C[C@@H]1NC(=O)OCc1ccccc1	ZINC000685958790	564177068	/nfs/dbraw/zinc/17/70/68/564177068.db2.gz	GOYWLRYGLZWYEK-GJYPPUQNSA-N	-1	0	331.412	3.582	10	0		EHAERM
O=C([O-])c1csc(CSc2ncccc2Br)c1	ZINC000711406841	977544926	/nfs/dbraw/zinc/54/49/26/977544926.db2.gz	KFMVNKCLRKFPON-UHFFFAOYSA-N	-1	0	330.228	3.896	10	0		EHAERM
O=C(NC[C@@H]1CCOC2(CCC2)C1)c1ccc(Cl)c(Cl)c1[O-]	ZINC000333085885	1137954947	/nfs/dbraw/zinc/95/49/47/1137954947.db2.gz	NBKUYWBHJSVHBC-SNVBAGLBSA-N	-1	0	344.238	3.778	10	0		EHAERM
O=C([O-])c1c(F)cccc1-c1ccc(C(=O)N2CCCCC2)cc1	ZINC000065355337	214873903	/nfs/dbraw/zinc/87/39/03/214873903.db2.gz	KJZUHSYCXBXENQ-UHFFFAOYSA-N	-1	0	327.355	3.817	10	0		EHAERM
O=C([O-])c1ccc(COc2ccc(Cl)cc2Br)o1	ZINC000002521396	209864278	/nfs/dbraw/zinc/86/42/78/209864278.db2.gz	FPVHMEJPKBJICF-UHFFFAOYSA-N	-1	0	331.549	3.973	10	0		EHAERM
O=C([O-])C1CCN(C(=O)c2cc3ccccc3n2-c2ccccc2)CC1	ZINC000040802978	213388654	/nfs/dbraw/zinc/38/86/54/213388654.db2.gz	SZNKATOYBQTWIH-UHFFFAOYSA-N	-1	0	348.402	3.567	10	0		EHAERM
Nc1ccc(Oc2ccc(F)cc2Br)c(C(=O)[O-])c1	ZINC000037933309	213175458	/nfs/dbraw/zinc/17/54/58/213175458.db2.gz	PPXNMXJDKOOKBM-UHFFFAOYSA-N	-1	0	326.121	3.661	10	0		EHAERM
CC(C)c1cc(OCC(=O)[O-])nc(Nc2cccc3ccccc32)n1	ZINC000073698135	216413114	/nfs/dbraw/zinc/41/31/14/216413114.db2.gz	LYNVUJGVMRBGJP-UHFFFAOYSA-N	-1	0	337.379	3.960	10	0		EHAERM
Cc1cc(C)cc(O[C@@H](C)C(=O)Nc2ccc(C(=O)[O-])cc2C)c1	ZINC000021026662	212201058	/nfs/dbraw/zinc/20/10/58/212201058.db2.gz	JNGFIUVIQCOKTE-AWEZNQCLSA-N	-1	0	327.380	3.716	10	0		EHAERM
C[C@H]1CCc2c(sc(NC(=O)COc3ccccc3)c2C(=O)[O-])C1	ZINC000020333713	212120617	/nfs/dbraw/zinc/12/06/17/212120617.db2.gz	XICZNOPRXKYFMZ-NSHDSACASA-N	-1	0	345.420	3.589	10	0		EHAERM
Cc1c(Br)c(C(=O)[O-])nn1-c1ccc(C)c(Cl)c1	ZINC000049899236	214035753	/nfs/dbraw/zinc/03/57/53/214035753.db2.gz	KHJKEVVOPIVTSG-UHFFFAOYSA-N	-1	0	329.581	3.603	10	0		EHAERM
CC(C)(C(=O)[O-])[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000253180578	564091711	/nfs/dbraw/zinc/09/17/11/564091711.db2.gz	DLZKRIOITNHCFC-MRXNPFEDSA-N	-1	0	327.380	3.765	10	0		EHAERM
O=C([O-])C1(C(=O)Nc2ccc(Cl)cc2Cl)CCSCC1	ZINC000707400260	954968478	/nfs/dbraw/zinc/96/84/78/954968478.db2.gz	UJHLVCINEZZFKJ-UHFFFAOYSA-N	-1	0	334.224	3.530	10	0		EHAERM
Cc1oc(CNc2cc(F)c(Br)c(F)c2)cc1C(=O)[O-]	ZINC000689664885	976259854	/nfs/dbraw/zinc/25/98/54/976259854.db2.gz	OEANOHXFNXDQBL-UHFFFAOYSA-N	-1	0	346.127	3.939	10	0		EHAERM
Cc1cc(OCc2ccccc2)ccc1NC(=O)N[C@@H](C)CC(=O)[O-]	ZINC000691053035	976346376	/nfs/dbraw/zinc/34/63/76/976346376.db2.gz	QQVGFHOGKGLDMY-AWEZNQCLSA-N	-1	0	342.395	3.559	10	0		EHAERM
C[C@H]1CCCC[C@H]1C(=O)Nc1ccc(Br)cc1C(=O)[O-]	ZINC000714402254	977671437	/nfs/dbraw/zinc/67/14/37/977671437.db2.gz	SOBZNDHYOCYILC-GXSJLCMTSA-N	-1	0	340.217	3.912	10	0		EHAERM
C[C@H]1CCCC[C@H]1C(=O)Nc1cc(Br)ccc1C(=O)[O-]	ZINC000714401943	977671482	/nfs/dbraw/zinc/67/14/82/977671482.db2.gz	PFSIMVRAJRQOMV-GXSJLCMTSA-N	-1	0	340.217	3.912	10	0		EHAERM
C[C@@H]1OCCC[C@@H]1C(=O)Nc1cc(Br)cc(Cl)c1[O-]	ZINC000276649410	1022050598	/nfs/dbraw/zinc/05/05/98/1022050598.db2.gz	CVVPHJNTCQPJBV-CBAPKCEASA-N	-1	0	348.624	3.562	10	0		EHAERM
O=C([O-])[C@@H]1CCC[C@@H](C(=O)N2CCC[C@H]2/C=C/c2ccccc2)C1	ZINC000262759526	1029631852	/nfs/dbraw/zinc/63/18/52/1029631852.db2.gz	KOAGJBWLODCCEW-VJQPNKNBSA-N	-1	0	327.424	3.582	10	0		EHAERM
O=C([O-])[C@H]1C[C@H](c2ccccc2)CN(C(=O)c2coc3ccccc23)C1	ZINC000180303673	1031877646	/nfs/dbraw/zinc/87/76/46/1031877646.db2.gz	NCFAGUIMGCMQQL-HOTGVXAUSA-N	-1	0	349.386	3.763	10	0		EHAERM
O=C([O-])[C@@H]1C[C@H](c2ccccc2)CN(C(=O)c2coc3ccccc23)C1	ZINC000180303705	1031877854	/nfs/dbraw/zinc/87/78/54/1031877854.db2.gz	NCFAGUIMGCMQQL-JKSUJKDBSA-N	-1	0	349.386	3.763	10	0		EHAERM
C[C@H](C(=O)N1C[C@@H](C(=O)[O-])C[C@@H](c2ccccc2)C1)c1cccs1	ZINC000180340153	1031878840	/nfs/dbraw/zinc/87/88/40/1031878840.db2.gz	RXRAUGYEPGZZKF-IMJJTQAJSA-N	-1	0	343.448	3.569	10	0		EHAERM
COc1cccc(C(=O)Nc2sc3c(c2C(=O)[O-])CC[C@H](C)C3)c1	ZINC000020333629	212120822	/nfs/dbraw/zinc/12/08/22/212120822.db2.gz	IOTROHFFXSTALU-JTQLQIEISA-N	-1	0	345.420	3.832	10	0		EHAERM
CCc1ccc(-c2csc3ncnc(N(C)CCC(=O)[O-])c23)cc1	ZINC000020317894	212118421	/nfs/dbraw/zinc/11/84/21/212118421.db2.gz	ACDZPVDMHBHSQJ-UHFFFAOYSA-N	-1	0	341.436	3.832	10	0		EHAERM
CCOc1ccc(-c2csc3ncnc(NCCC(=O)[O-])c23)cc1	ZINC000020313882	212118088	/nfs/dbraw/zinc/11/80/88/212118088.db2.gz	VNHGGFNFJVQEKM-UHFFFAOYSA-N	-1	0	343.408	3.644	10	0		EHAERM
COc1ccc2ccccc2c1CNc1nc(CC(=O)[O-])cs1	ZINC000008018495	210883919	/nfs/dbraw/zinc/88/39/19/210883919.db2.gz	VPJSSRYNBYUZBI-UHFFFAOYSA-N	-1	0	328.393	3.544	10	0		EHAERM
CC(C)(C)OC(=O)N[C@H](CCc1ccc2ccccc2c1)C(=O)[O-]	ZINC000095749296	218447652	/nfs/dbraw/zinc/44/76/52/218447652.db2.gz	RBGNOZINYUCSMY-MRXNPFEDSA-N	-1	0	329.396	3.750	10	0		EHAERM
Cc1nc(-c2ccc(CSc3ccc(C)cc3)o2)n(CC(=O)[O-])n1	ZINC000097447049	219025418	/nfs/dbraw/zinc/02/54/18/219025418.db2.gz	XDSFHDMKDCBACS-UHFFFAOYSA-N	-1	0	343.408	3.532	10	0		EHAERM
O=C([O-])C1CCN(c2nc(Cl)nc3c4ccccc4sc32)CC1	ZINC000073736337	135620682	/nfs/dbraw/zinc/62/06/82/135620682.db2.gz	QHCQCBSPUISRNJ-UHFFFAOYSA-N	-1	0	347.827	3.799	10	0		EHAERM
O=C([O-])c1sc(Br)cc1CC(F)(F)C(F)(F)F	ZINC000675057948	564112131	/nfs/dbraw/zinc/11/21/31/564112131.db2.gz	NVUXUSWEVNQBBM-UHFFFAOYSA-N	-1	0	339.079	3.949	10	0		EHAERM
O=C([O-])c1cc(-c2cccc(O)c2)nc2n[nH]c(-c3ccc(F)cc3)c21	ZINC000006749024	564097065	/nfs/dbraw/zinc/09/70/65/564097065.db2.gz	JMHQVTNZHSTXFQ-UHFFFAOYSA-N	-1	0	349.321	3.835	10	0		EHAERM
CCN(CC)c1ncc(NC(=O)c2ccccc2Cl)cc1C(=O)[O-]	ZINC000064978742	564098866	/nfs/dbraw/zinc/09/88/66/564098866.db2.gz	UQDADIIEOWQKAX-UHFFFAOYSA-N	-1	0	347.802	3.532	10	0		EHAERM
O=C([O-])c1ccc(Br)c(NC(=O)[C@@H]2CCC[C@H]3C[C@H]32)c1	ZINC000694341275	954775142	/nfs/dbraw/zinc/77/51/42/954775142.db2.gz	AQQFNMSFNLGSBE-JMJZKYOTSA-N	-1	0	338.201	3.522	10	0		EHAERM
CC[C@H](C)CCNC(=O)Nc1cc(C(=O)[O-])ccc1Br	ZINC000696422746	954818374	/nfs/dbraw/zinc/81/83/74/954818374.db2.gz	KYFIWCFKAWZQJM-VIFPVBQESA-N	-1	0	343.221	3.705	10	0		EHAERM
CCc1cc2c(ncnc2N(CCC(=O)[O-])Cc2ccccc2)s1	ZINC000692531634	976524487	/nfs/dbraw/zinc/52/44/87/976524487.db2.gz	DLTMOYHRXDZGIO-UHFFFAOYSA-N	-1	0	341.436	3.735	10	0		EHAERM
O=C([O-])c1c(NC(=O)c2cscc2Cl)sc2c1CCC2	ZINC000711238357	977531373	/nfs/dbraw/zinc/53/13/73/977531373.db2.gz	XVQHVSFOVVGRLA-UHFFFAOYSA-N	-1	0	327.814	3.902	10	0		EHAERM
Cc1cc(C(=O)[O-])oc1C(=O)N(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000717209693	977878150	/nfs/dbraw/zinc/87/81/50/977878150.db2.gz	QFGBPTJDXTYOTA-ZDUSSCGKSA-N	-1	0	327.380	3.727	10	0		EHAERM
Cc1coc(C(=O)Nc2cc(C(=O)[O-])c(Br)cc2C)c1	ZINC000718515813	977972310	/nfs/dbraw/zinc/97/23/10/977972310.db2.gz	BDTZCVVXGMOMIW-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
CO[C@@H](C)c1cccc(NS(=O)(=O)c2ccc3c(c2)C[C@@H](C)O3)c1	ZINC000106007646	1037292434	/nfs/dbraw/zinc/29/24/34/1037292434.db2.gz	QTNNMTXEVQUGOY-OLZOCXBDSA-N	-1	0	347.436	3.518	10	0		EHAERM
Nc1cc(F)c(Nc2cccc(Br)c2)cc1C(=O)[O-]	ZINC000050019115	214040570	/nfs/dbraw/zinc/04/05/70/214040570.db2.gz	FTQZHDZVSFBFNF-UHFFFAOYSA-N	-1	0	325.137	3.612	10	0		EHAERM
Cc1cccc(Nc2ncnc(Nc3ccc(C(=O)[O-])cc3)c2N)c1	ZINC000040781722	213385656	/nfs/dbraw/zinc/38/56/56/213385656.db2.gz	QOKOIAJZEJJRQZ-UHFFFAOYSA-N	-1	0	335.367	3.553	10	0		EHAERM
COc1ccc(-c2nc(C)cc(Nc3ccc(C(=O)[O-])cc3)n2)cc1	ZINC000070455640	215693877	/nfs/dbraw/zinc/69/38/77/215693877.db2.gz	HRKGVNAXZFYDCG-UHFFFAOYSA-N	-1	0	335.363	3.902	10	0		EHAERM
Cc1ccc(Cn2nnc(C(=O)[O-])c2-c2cccc(Cl)c2)c(C)c1	ZINC000070457070	215694693	/nfs/dbraw/zinc/69/46/93/215694693.db2.gz	DDHBSRORYGSFHD-UHFFFAOYSA-N	-1	0	341.798	3.962	10	0		EHAERM
Cc1ccc(-c2nc(OCC(=O)[O-])cc(-c3cccc(C)c3)n2)cc1	ZINC000073696460	216413124	/nfs/dbraw/zinc/41/31/24/216413124.db2.gz	JOKQRBDKZPYZAC-UHFFFAOYSA-N	-1	0	334.375	3.891	10	0		EHAERM
C[C@H]1CCc2c(sc(NC(=O)Cc3cccs3)c2C(=O)[O-])C1	ZINC000020333682	212120851	/nfs/dbraw/zinc/12/08/51/212120851.db2.gz	HXZRYWLVBYITMR-VIFPVBQESA-N	-1	0	335.450	3.814	10	0		EHAERM
Cc1sc(NC(=O)COc2ccccc2Cl)c(C(=O)[O-])c1C	ZINC000020332808	212119794	/nfs/dbraw/zinc/11/97/94/212119794.db2.gz	WCPNWTQPONWUIG-UHFFFAOYSA-N	-1	0	339.800	3.734	10	0		EHAERM
O=C([O-])[C@H]1CCCN1c1ncnc2scc(-c3ccc(F)cc3)c21	ZINC000020317991	212118849	/nfs/dbraw/zinc/11/88/49/212118849.db2.gz	CACBAIZEQDBZPF-CYBMUJFWSA-N	-1	0	343.383	3.551	10	0		EHAERM
O=C([O-])c1nc(Oc2cccc(Br)c2)ccc1Cl	ZINC000019965772	212090747	/nfs/dbraw/zinc/09/07/47/212090747.db2.gz	ULBAUGNSVGQDSX-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
CCCCOc1c(Br)cc(/C=C/C(=O)[O-])cc1OC	ZINC000005951559	210564862	/nfs/dbraw/zinc/56/48/62/210564862.db2.gz	WDOADWGLUYPFEO-AATRIKPKSA-N	-1	0	329.190	3.734	10	0		EHAERM
O=C([O-])Cn1c2ccccc2nc1Nc1ccc(Br)cc1	ZINC000057326662	527642106	/nfs/dbraw/zinc/64/21/06/527642106.db2.gz	GEKFMYKRDPCORM-UHFFFAOYSA-N	-1	0	346.184	3.627	10	0		EHAERM
Cc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C(=O)[O-])c(Cl)c1	ZINC000409422237	563962051	/nfs/dbraw/zinc/96/20/51/563962051.db2.gz	CWCVWYQXUQWCRI-QWHCGFSZSA-N	-1	0	339.819	3.684	10	0		EHAERM
CCOc1ccccc1[C@H](CC(=O)[O-])NC(=O)OCc1ccccc1	ZINC000226849089	564117326	/nfs/dbraw/zinc/11/73/26/564117326.db2.gz	GVZDUDHTIABXOY-INIZCTEOSA-N	-1	0	343.379	3.528	10	0		EHAERM
CC(C)[C@H]1CC[C@@H](C)C[C@@]1(NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000226769328	564118267	/nfs/dbraw/zinc/11/82/67/564118267.db2.gz	QDPBBDIEAIDFSL-OGWOLHLISA-N	-1	0	333.428	3.828	10	0		EHAERM
O=C([O-])c1cc(COc2ccc(F)c(Br)c2)cs1	ZINC000689109906	976224187	/nfs/dbraw/zinc/22/41/87/976224187.db2.gz	ZRBLQJNWGSHIRL-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
Cc1oc(C(=O)[O-])cc1C(=O)Nc1cc(C)ccc1Br	ZINC000689116462	976227510	/nfs/dbraw/zinc/22/75/10/976227510.db2.gz	HMFKMFCKWMQPQA-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
Cc1oc(C(=O)[O-])cc1C(=O)Nc1ccc(Br)c(C)c1	ZINC000689120416	976229611	/nfs/dbraw/zinc/22/96/11/976229611.db2.gz	ZZRODONBMDNIGL-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
O=C([O-])CN(Cc1cscc1Br)Cc1ccccc1	ZINC000692410712	976451711	/nfs/dbraw/zinc/45/17/11/976451711.db2.gz	SFRKGMQTOMRSER-UHFFFAOYSA-N	-1	0	340.242	3.597	10	0		EHAERM
COc1ccc(Cl)cc1C[N@H+](CCC(=O)[O-])Cc1ccccc1	ZINC000692462171	976493479	/nfs/dbraw/zinc/49/34/79/976493479.db2.gz	SVZHOSOYEBMIGA-UHFFFAOYSA-N	-1	0	333.815	3.826	10	0		EHAERM
CO[C@H](C)c1cccc([N-]S(=O)(=O)c2cc(F)c(F)cc2F)c1	ZINC000105591934	1037217269	/nfs/dbraw/zinc/21/72/69/1037217269.db2.gz	PRRAPKRFLBXPHT-SECBINFHSA-N	-1	0	345.342	3.612	10	0		EHAERM
C[C@@H]1OCCC[C@H]1C(=O)Nc1cc(Cl)cc(Br)c1[O-]	ZINC000189810202	1140364825	/nfs/dbraw/zinc/36/48/25/1140364825.db2.gz	ARDHLYPDHYNPFP-IONNQARKSA-N	-1	0	348.624	3.562	10	0		EHAERM
CC(C)(C)OC(=O)N1CCC[C@]2(C[C@@H](CC(=O)[O-])c3ccccc32)C1	ZINC000051943349	214109992	/nfs/dbraw/zinc/10/99/92/214109992.db2.gz	NOYSNFSVSDDBJL-VLIAUNLRSA-N	-1	0	345.439	3.917	10	0		EHAERM
O=C([O-])[C@H]1CCC[C@H](CC(=O)c2ccc(Br)cc2)C1	ZINC000098090442	219083312	/nfs/dbraw/zinc/08/33/12/219083312.db2.gz	WVEXAXHAJBDHPX-JQWIXIFHSA-N	-1	0	325.202	3.913	10	0		EHAERM
O=C([O-])Cc1ccc(-n2c3ncccc3nc2-c2ccccc2)cc1	ZINC000049454043	214009330	/nfs/dbraw/zinc/00/93/30/214009330.db2.gz	ZLMWWQTZNAXTCH-UHFFFAOYSA-N	-1	0	329.359	3.715	10	0		EHAERM
O=C(C=C([O-])c1cc(-c2cccs2)on1)c1cc(F)ccc1O	ZINC000100754698	219106005	/nfs/dbraw/zinc/10/60/05/219106005.db2.gz	DIVRVUZMGVMXLI-UHFFFAOYSA-N	-1	0	331.324	3.704	10	0		EHAERM
O=C([O-])c1ccnc(Oc2ccc(Br)cc2Cl)c1	ZINC000020362504	212122865	/nfs/dbraw/zinc/12/28/65/212122865.db2.gz	TVWPPBZSXBBRNB-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
O=C([O-])c1[nH]c2ccc(Cl)cc2c1CC(=O)Nc1ccc(F)cc1	ZINC000004920224	210324476	/nfs/dbraw/zinc/32/44/76/210324476.db2.gz	XRKSSOIIHRGNTE-UHFFFAOYSA-N	-1	0	346.745	3.840	10	0		EHAERM
CCc1nc(NCc2ccc(C(C)C)cc2)nc(OCC(=O)[O-])c1C	ZINC000073705457	522406279	/nfs/dbraw/zinc/40/62/79/522406279.db2.gz	MUTYJCGGNDGBQT-UHFFFAOYSA-N	-1	0	343.427	3.546	10	0		EHAERM
C[C@@H]1CC(C)(C)C[C@](CNC(=O)OCc2ccccc2)(C(=O)[O-])C1	ZINC000725245532	563976005	/nfs/dbraw/zinc/97/60/05/563976005.db2.gz	VGDWOUHBBFESSO-AUUYWEPGSA-N	-1	0	333.428	3.830	10	0		EHAERM
COc1ccc(-c2csc3ncnc(S[C@@H](C)C(=O)[O-])c23)cc1	ZINC000005414297	956873268	/nfs/dbraw/zinc/87/32/68/956873268.db2.gz	AJSHZEHCUQQNOA-VIFPVBQESA-N	-1	0	346.433	3.932	10	0		EHAERM
CCCCOc1ccc(C(=O)N(CC(=O)[O-])Cc2ccccc2)cc1	ZINC000692422390	976461882	/nfs/dbraw/zinc/46/18/82/976461882.db2.gz	WNAKWUMLRNOQRF-UHFFFAOYSA-N	-1	0	341.407	3.593	10	0		EHAERM
CC1(C)C[C@@H](Sc2ccc(Br)cc2C(=O)[O-])CO1	ZINC000703058866	977149894	/nfs/dbraw/zinc/14/98/94/977149894.db2.gz	XFHVNUOQDJPTRZ-SECBINFHSA-N	-1	0	331.231	3.807	10	0		EHAERM
CC(C)(CCNc1nc2cc(Br)ccc2o1)C(=O)[O-]	ZINC000705876744	977298713	/nfs/dbraw/zinc/29/87/13/977298713.db2.gz	OJMRMJXTPJAWQV-UHFFFAOYSA-N	-1	0	327.178	3.503	10	0		EHAERM
O=C([O-])C[C@H]1CCCCN1Cc1cccc(Br)c1Cl	ZINC000706413963	977314808	/nfs/dbraw/zinc/31/48/08/977314808.db2.gz	JXBGQIKWBCVSOC-LLVKDONJSA-N	-1	0	346.652	3.932	10	0		EHAERM
O=C([O-])c1ccc(C(=O)Nc2cccc(Br)c2Cl)o1	ZINC000709162101	977453604	/nfs/dbraw/zinc/45/36/04/977453604.db2.gz	YJTGUDJHZZCEEN-UHFFFAOYSA-N	-1	0	344.548	3.646	10	0		EHAERM
CN(Cc1cscc1Br)Cc1cccc(C(=O)[O-])c1	ZINC000709870345	977471950	/nfs/dbraw/zinc/47/19/50/977471950.db2.gz	QWQCWUVFWGZPNI-UHFFFAOYSA-N	-1	0	340.242	3.841	10	0		EHAERM
O=C([O-])c1csc(COc2cc(Br)ccc2F)c1	ZINC000711422050	977545868	/nfs/dbraw/zinc/54/58/68/977545868.db2.gz	FOPDOHJRRYOGRG-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
C[C@@H]1CCCC[C@H]1C(=O)Nc1cc(Br)ccc1C(=O)[O-]	ZINC000714401947	977671479	/nfs/dbraw/zinc/67/14/79/977671479.db2.gz	PFSIMVRAJRQOMV-MWLCHTKSSA-N	-1	0	340.217	3.912	10	0		EHAERM
CCOc1cc(F)ccc1[N-]S(=O)(=O)c1cccc2ncccc21	ZINC000102319976	1036230242	/nfs/dbraw/zinc/23/02/42/1036230242.db2.gz	YOHFXNSQRKIYOM-UHFFFAOYSA-N	-1	0	346.383	3.573	10	0		EHAERM
Cc1[nH]c2ccc(C(=O)N3[C@@H]4CCCC[C@H]4C[C@H]3C(=O)[O-])cc2c1C	ZINC000326690712	1128430746	/nfs/dbraw/zinc/43/07/46/1128430746.db2.gz	QWGXZPXVOCWLFD-VHSSKADRSA-N	-1	0	340.423	3.643	10	0		EHAERM
C[C@H]1OCCC[C@@H]1C(=O)Nc1cc(Cl)cc(Br)c1[O-]	ZINC000189810219	1140365225	/nfs/dbraw/zinc/36/52/25/1140365225.db2.gz	ARDHLYPDHYNPFP-APPZFPTMSA-N	-1	0	348.624	3.562	10	0		EHAERM
O=C([O-])[C@H](Cc1ccccc1)SCc1ccc(Br)o1	ZINC000037527773	213154236	/nfs/dbraw/zinc/15/42/36/213154236.db2.gz	MMSSIXQXLBJJKF-LBPRGKRZSA-N	-1	0	341.226	3.971	10	0		EHAERM
Cc1c(Cl)cccc1Nc1nc(OCC(=O)[O-])cc(C(C)(C)C)n1	ZINC000073704176	216415170	/nfs/dbraw/zinc/41/51/70/216415170.db2.gz	CUQFDVXAKFYCJJ-UHFFFAOYSA-N	-1	0	349.818	3.943	10	0		EHAERM
O=C([O-])C[C@H]1c2ccccc2CCN1C(=O)Nc1ccc(F)cc1F	ZINC000021044499	212203578	/nfs/dbraw/zinc/20/35/78/212203578.db2.gz	QYZLYENDMGZHJU-INIZCTEOSA-N	-1	0	346.333	3.571	10	0		EHAERM
COc1cccc(C(=O)Nc2sc3c(c2C(=O)[O-])CC[C@@H](C)C3)c1	ZINC000020333632	212120594	/nfs/dbraw/zinc/12/05/94/212120594.db2.gz	IOTROHFFXSTALU-SNVBAGLBSA-N	-1	0	345.420	3.832	10	0		EHAERM
C[C@H]1CCc2c(sc(NC(=O)c3ccc(F)cc3)c2C(=O)[O-])C1	ZINC000020333621	212120235	/nfs/dbraw/zinc/12/02/35/212120235.db2.gz	QZIHXWALFATFCV-VIFPVBQESA-N	-1	0	333.384	3.963	10	0		EHAERM
O=C([O-])[C@@H]1CCCN1c1ncnc2scc(-c3ccc(F)cc3)c21	ZINC000020317987	212118938	/nfs/dbraw/zinc/11/89/38/212118938.db2.gz	CACBAIZEQDBZPF-ZDUSSCGKSA-N	-1	0	343.383	3.551	10	0		EHAERM
O=C([O-])c1nc(Oc2ccccc2Br)ccc1Cl	ZINC000019965823	212090652	/nfs/dbraw/zinc/09/06/52/212090652.db2.gz	UJADOWZAHYEATC-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
CC(C)(C)OC(=O)Nc1sc(-c2ccccc2F)nc1C(=O)[O-]	ZINC000091690895	218047558	/nfs/dbraw/zinc/04/75/58/218047558.db2.gz	OZKZIDYVQQPLIU-UHFFFAOYSA-N	-1	0	338.360	3.994	10	0		EHAERM
CC(C)(C)[C@H]1CC(=C([O-])C(F)(F)F)C(O)=C(C(=O)C(F)(F)F)C1	ZINC000242677076	258000505	/nfs/dbraw/zinc/00/05/05/258000505.db2.gz	SXXAGMRKHAMBDV-WHUPJOBBSA-N	-1	0	346.267	3.507	10	0		EHAERM
CC[C@@H]1CCc2c(sc(I)c2C(=O)[O-])C1	ZINC000725246499	563976116	/nfs/dbraw/zinc/97/61/16/563976116.db2.gz	NYZBWXXWWKPLIH-ZCFIWIBFSA-N	-1	0	336.194	3.566	10	0		EHAERM
C[C@@H]1CCC[C@H](C[C@@H](CNC(=O)OCc2ccccc2)C(=O)[O-])C1	ZINC000725245195	563975915	/nfs/dbraw/zinc/97/59/15/563975915.db2.gz	BHGKNLZLPURLFA-PVAVHDDUSA-N	-1	0	333.428	3.830	10	0		EHAERM
C[C@@H]1CCCC[C@H]1C[C@@H](CNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000725246871	563976162	/nfs/dbraw/zinc/97/61/62/563976162.db2.gz	ZLQFDVMJXGSMOV-PVAVHDDUSA-N	-1	0	333.428	3.830	10	0		EHAERM
Cc1sc([C@@H]2CCCN2C(=O)OCc2ccccc2)nc1C(=O)[O-]	ZINC000685949162	564177034	/nfs/dbraw/zinc/17/70/34/564177034.db2.gz	KQXOIJVRMCHNGY-ZDUSSCGKSA-N	-1	0	346.408	3.623	10	0		EHAERM
C[C@@H]1CC[C@@H](C)N1C(=O)Nc1cc(C(=O)[O-])ccc1Br	ZINC000707000542	954962507	/nfs/dbraw/zinc/96/25/07/954962507.db2.gz	AINZCZWWQJLRLN-RKDXNWHRSA-N	-1	0	341.205	3.552	10	0		EHAERM
O=C([O-])c1cccc(CN2Cc3ccc(Br)cc3C2)c1	ZINC000707900649	954977487	/nfs/dbraw/zinc/97/74/87/954977487.db2.gz	ZPOCDZVLRHUXJG-UHFFFAOYSA-N	-1	0	332.197	3.663	10	0		EHAERM
O=C([O-])CCN(Cc1csc(-c2ccco2)n1)Cc1ccccc1	ZINC000692494932	976511485	/nfs/dbraw/zinc/51/14/85/976511485.db2.gz	LBRHRMKSVZYMIP-UHFFFAOYSA-N	-1	0	342.420	3.880	10	0		EHAERM
CC(C)(C)[C@@H]1C[C@H]1C(=O)Nc1cc(Br)ccc1C(=O)[O-]	ZINC000699983285	976932277	/nfs/dbraw/zinc/93/22/77/976932277.db2.gz	SSXQYLRCFNOYMH-GHMZBOCLSA-N	-1	0	340.217	3.768	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OCOC2CCCCC2)c1	ZINC000700724630	976967161	/nfs/dbraw/zinc/96/71/61/976967161.db2.gz	MVXGMNAFEHCTPD-UHFFFAOYSA-N	-1	0	329.190	3.833	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OC[C@@H]2CCC(F)(F)C2)c1	ZINC000700751790	976968088	/nfs/dbraw/zinc/96/80/88/976968088.db2.gz	IYGCPFHGTLNCKG-MRVPVSSYSA-N	-1	0	335.144	3.962	10	0		EHAERM
O=C([O-])c1ccoc1CN1CCCc2cc(Br)ccc21	ZINC000713319554	977633069	/nfs/dbraw/zinc/63/30/69/977633069.db2.gz	HPQCRQAOPUMDDB-UHFFFAOYSA-N	-1	0	336.185	3.693	10	0		EHAERM
C[C@H](c1ccccc1Br)N(C)Cc1ccc(C(=O)[O-])o1	ZINC000724843584	978245382	/nfs/dbraw/zinc/24/53/82/978245382.db2.gz	JZJHUKCWRWCNPG-SNVBAGLBSA-N	-1	0	338.201	3.933	10	0		EHAERM
O=C(N[C@@H]1CCCC[C@@H]1n1cccn1)c1ccc2[n-]c(=S)oc2c1	ZINC000074470729	1028615975	/nfs/dbraw/zinc/61/59/75/1028615975.db2.gz	UWHFMYLGXGMZOJ-OCCSQVGLSA-N	-1	0	342.424	3.601	10	0		EHAERM
O=C(N[C@@H]1CCOC2(CCC2)C1)c1ccc(Cl)c(Cl)c1[O-]	ZINC000269012711	1128735917	/nfs/dbraw/zinc/73/59/17/1128735917.db2.gz	BRAHQEZHHBACLV-SECBINFHSA-N	-1	0	330.211	3.531	10	0		EHAERM
Cc1cc(=O)oc2cc(Oc3coc4cc([O-])ccc4c3=O)ccc12	ZINC000004226057	210146269	/nfs/dbraw/zinc/14/62/69/210146269.db2.gz	FNRMLKGEEODQQY-UHFFFAOYSA-N	-1	0	336.299	3.706	10	0		EHAERM
C[C@@](NCC(F)(F)F)(C(=O)[O-])c1cc(F)c(Cl)cc1Cl	ZINC000037973304	213177880	/nfs/dbraw/zinc/17/78/80/213177880.db2.gz	PPOYWELMLFJNEX-JTQLQIEISA-N	-1	0	334.096	3.584	10	0		EHAERM
O=C([O-])c1cccnc1SCc1ccc(Br)cc1F	ZINC000035082690	213007388	/nfs/dbraw/zinc/00/73/88/213007388.db2.gz	UGOPVZKGNRWJOJ-UHFFFAOYSA-N	-1	0	342.189	3.974	10	0		EHAERM
Cc1cc(Br)c2nc(C)cc(SCC(=O)[O-])c2c1	ZINC000072237361	216076478	/nfs/dbraw/zinc/07/64/78/216076478.db2.gz	JKRUMHICAYHZBU-UHFFFAOYSA-N	-1	0	326.215	3.791	10	0		EHAERM
O=C([O-])c1ccccc1[S@@](=O)Cc1ccc(Br)s1	ZINC000037922847	213173551	/nfs/dbraw/zinc/17/35/51/213173551.db2.gz	QYNAWBRKMWLUOM-GOSISDBHSA-N	-1	0	345.239	3.517	10	0		EHAERM
CCN(CC)c1cc(C(=O)[O-])c2cc(NC(=O)CC(C)C)ccc2n1	ZINC000021886119	212260133	/nfs/dbraw/zinc/26/01/33/212260133.db2.gz	CMEOTDUSUMSKJH-UHFFFAOYSA-N	-1	0	343.427	3.764	10	0		EHAERM
Cc1sc(NC(=O)C(C)(C)C)nc1-c1ccc(OCC(=O)[O-])cc1	ZINC000020340540	212120451	/nfs/dbraw/zinc/12/04/51/212120451.db2.gz	VSCDDAMHBSHYFW-UHFFFAOYSA-N	-1	0	348.424	3.567	10	0		EHAERM
Cc1sc(NC(=O)COc2ccc(Cl)cc2)c(C(=O)[O-])c1C	ZINC000020332736	212119217	/nfs/dbraw/zinc/11/92/17/212119217.db2.gz	DUPGFLPGKOCFSE-UHFFFAOYSA-N	-1	0	339.800	3.734	10	0		EHAERM
O=C([O-])Cc1ccc(OCc2ccc(Br)s2)cc1	ZINC000019843639	212075678	/nfs/dbraw/zinc/07/56/78/212075678.db2.gz	YRQJXFPBEMGRTJ-UHFFFAOYSA-N	-1	0	327.199	3.717	10	0		EHAERM
CCN1C(=O)c2ccccc2[C@H](C(=O)[O-])[C@H]1c1cn(C)c2ccccc12	ZINC000033413900	563916062	/nfs/dbraw/zinc/91/60/62/563916062.db2.gz	QNNLEBHQVZJZFX-RBUKOAKNSA-N	-1	0	348.402	3.564	10	0		EHAERM
COc1cccc2c1N(C(=O)OC(C)(C)C)[C@H](C)C[C@H]2CC(=O)[O-]	ZINC000725253633	563982171	/nfs/dbraw/zinc/98/21/71/563982171.db2.gz	CHHWYIJJOZAFBE-NEPJUHHUSA-N	-1	0	335.400	3.787	10	0		EHAERM
CC(C)(C)[C@H]1CCCC[C@@]1(NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000226769096	564118247	/nfs/dbraw/zinc/11/82/47/564118247.db2.gz	ZEHMJQJVAHUPOO-BEFAXECRSA-N	-1	0	333.428	3.973	10	0		EHAERM
O=C([O-])c1ccc(NC(=O)c2ccsc2Br)c(F)c1	ZINC000698552430	954844778	/nfs/dbraw/zinc/84/47/78/954844778.db2.gz	OTJDVKIHEMOVIL-UHFFFAOYSA-N	-1	0	344.161	3.600	10	0		EHAERM
Cc1oc(C(=O)[O-])cc1CN1Cc2cccc(Br)c2C1	ZINC000713193712	977631222	/nfs/dbraw/zinc/63/12/22/977631222.db2.gz	JVOHTTHXRWUMLD-UHFFFAOYSA-N	-1	0	336.185	3.565	10	0		EHAERM
CCOc1ccc(OC)cc1[N-]S(=O)(=O)c1cc(C)sc1C	ZINC000105389551	1037198685	/nfs/dbraw/zinc/19/86/85/1037198685.db2.gz	HSXMBXBPVSCTEZ-UHFFFAOYSA-N	-1	0	341.454	3.573	10	0		EHAERM
CCCCN(C)c1ncc(NC(=O)c2ccccc2C)cc1C(=O)[O-]	ZINC000064978469	214819192	/nfs/dbraw/zinc/81/91/92/214819192.db2.gz	JDMNXNUAYXXSLD-UHFFFAOYSA-N	-1	0	341.411	3.577	10	0		EHAERM
O=C([O-])c1sccc1OCc1ccc(F)cc1Br	ZINC000104069464	219344335	/nfs/dbraw/zinc/34/43/35/219344335.db2.gz	OUBPELQCOVHZBX-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
O=C([O-])c1ccc2c(c1)nc(COc1ccccc1)n2Cc1ccco1	ZINC000040409730	213299850	/nfs/dbraw/zinc/29/98/50/213299850.db2.gz	CMFNZBDYPRFTPG-UHFFFAOYSA-N	-1	0	348.358	3.955	10	0		EHAERM
CCOc1ccc(-c2cc(C(=O)[O-])c3c(C)noc3n2)cc1OCC	ZINC000040165783	213278702	/nfs/dbraw/zinc/27/87/02/213278702.db2.gz	YOXSHYVKGKVYGS-UHFFFAOYSA-N	-1	0	342.351	3.694	10	0		EHAERM
CC[C@H](C)Oc1c(Br)cc(/C=C/C(=O)[O-])cc1OC	ZINC000036815563	213119634	/nfs/dbraw/zinc/11/96/34/213119634.db2.gz	DDRWTVXXLWTAHK-CYNONHLPSA-N	-1	0	329.190	3.733	10	0		EHAERM
O=C([O-])c1nnn(Cc2cc(F)ccc2F)c1-c1ccc(Cl)cc1	ZINC000070457104	215695777	/nfs/dbraw/zinc/69/57/77/215695777.db2.gz	HSVQQTNTZWZIAR-UHFFFAOYSA-N	-1	0	349.724	3.623	10	0		EHAERM
O=C([O-])c1cc(-c2ccccn2)nc2cccc(Br)c21	ZINC000022163242	212280767	/nfs/dbraw/zinc/28/07/67/212280767.db2.gz	MEAYCKNBHJHPDS-UHFFFAOYSA-N	-1	0	329.153	3.758	10	0		EHAERM
C[C@H]1CCc2c(sc(NC(=O)c3cccc(F)c3)c2C(=O)[O-])C1	ZINC000020333616	212120545	/nfs/dbraw/zinc/12/05/45/212120545.db2.gz	STQBTOXCKWFHGN-VIFPVBQESA-N	-1	0	333.384	3.963	10	0		EHAERM
CN(CCC(=O)[O-])c1ncnc2scc(-c3ccc(Cl)cc3)c21	ZINC000020317924	212118966	/nfs/dbraw/zinc/11/89/66/212118966.db2.gz	URLUFEHPXBFQSF-UHFFFAOYSA-N	-1	0	347.827	3.923	10	0		EHAERM
CC(C)c1ccc(-c2csc3ncn(CCC(=O)[O-])c(=O)c23)cc1	ZINC000019954479	212089833	/nfs/dbraw/zinc/08/98/33/212089833.db2.gz	ZHMZJVARHFFCGO-UHFFFAOYSA-N	-1	0	342.420	3.723	10	0		EHAERM
O=C([O-])c1ccc(OCc2ccc(F)c(Br)c2)cc1	ZINC000019803145	212070283	/nfs/dbraw/zinc/07/02/83/212070283.db2.gz	KUWINXGZUWZMKG-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
O=C([O-])[C@@H]1Cc2c(cc(F)cc2Cl)N1C(=O)OCc1ccccc1	ZINC000584882274	563880812	/nfs/dbraw/zinc/88/08/12/563880812.db2.gz	YPBCWRXJKAGFOH-HNNXBMFYSA-N	-1	0	349.745	3.632	10	0		EHAERM
COc1ccc2c(c1)[C@@H](CC(=O)[O-])C[C@@H](C)N2C(=O)OC(C)(C)C	ZINC000725253853	563982248	/nfs/dbraw/zinc/98/22/48/563982248.db2.gz	MNUJRSOIYMIYMH-VXGBXAGGSA-N	-1	0	335.400	3.787	10	0		EHAERM
O=C([O-])[C@@H]1[C@@H](c2ccccc2)CCCN1C(=O)OCc1ccccc1	ZINC000725262393	564177747	/nfs/dbraw/zinc/17/77/47/564177747.db2.gz	VRCLCIGJFXSJBZ-MSOLQXFVSA-N	-1	0	339.391	3.656	10	0		EHAERM
C[C@H](C(=O)Nc1cc(C(=O)[O-])ccc1Br)C1CCC1	ZINC000692696327	954708156	/nfs/dbraw/zinc/70/81/56/954708156.db2.gz	CRGAJOXAPPMEBD-QMMMGPOBSA-N	-1	0	326.190	3.522	10	0		EHAERM
O=C([O-])C1(C(=O)Nc2cc(Cl)cc(Cl)c2)CCSCC1	ZINC000707399424	954967642	/nfs/dbraw/zinc/96/76/42/954967642.db2.gz	CGCZGQBNGCGCEY-UHFFFAOYSA-N	-1	0	334.224	3.530	10	0		EHAERM
C[C@@H](C(=O)Nc1ccc(Br)cc1C(=O)[O-])C1CCC1	ZINC000692698464	976537402	/nfs/dbraw/zinc/53/74/02/976537402.db2.gz	LXHGMJHCCKFORN-MRVPVSSYSA-N	-1	0	326.190	3.522	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OCc2cccc(F)c2)c1	ZINC000700739142	976966950	/nfs/dbraw/zinc/96/69/50/976966950.db2.gz	GAIKACDICPMBBG-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
O=C([O-])c1cc(Br)cc(OCc2scnc2Cl)c1	ZINC000721958097	978131407	/nfs/dbraw/zinc/13/14/07/978131407.db2.gz	CJJIXGVMFQLUMV-UHFFFAOYSA-N	-1	0	348.605	3.836	10	0		EHAERM
C[C@H](NC(=O)C1CCC(C(=O)[O-])CC1)c1nc(C(C)(C)C)cs1	ZINC000194412233	1024410779	/nfs/dbraw/zinc/41/07/79/1024410779.db2.gz	VCIKICSOSHDPFJ-UNXYVOJBSA-N	-1	0	338.473	3.509	10	0		EHAERM
O=C(c1cc(F)cc(Cl)c1[O-])N1CCC[C@@H](c2nccs2)C1	ZINC000132160440	1027889182	/nfs/dbraw/zinc/88/91/82/1027889182.db2.gz	WDFXUESURLHGQU-SECBINFHSA-N	-1	0	340.807	3.661	10	0		EHAERM
Cc1c(Cl)cccc1NC(=O)COc1ccc(/C=C/C(=O)[O-])cc1	ZINC000004227850	210148876	/nfs/dbraw/zinc/14/88/76/210148876.db2.gz	FLZRYGNOCBDRBK-JXMROGBWSA-N	-1	0	345.782	3.764	10	0		EHAERM
Cc1ccc(C)c(Nc2ncnc(Nc3ccc(C(=O)[O-])cc3)c2N)c1	ZINC000040704735	213371707	/nfs/dbraw/zinc/37/17/07/213371707.db2.gz	ITORUVAHAWVSRO-UHFFFAOYSA-N	-1	0	349.394	3.861	10	0		EHAERM
Nc1ccc(Nc2ccc(Br)cc2F)cc1C(=O)[O-]	ZINC000037930354	213174855	/nfs/dbraw/zinc/17/48/55/213174855.db2.gz	FAMTWZNVQYXCGJ-UHFFFAOYSA-N	-1	0	325.137	3.612	10	0		EHAERM
Cc1ccc(-c2c(C(=O)[O-])nnn2Cc2ccc(F)cc2Cl)cc1	ZINC000070457145	215695761	/nfs/dbraw/zinc/69/57/61/215695761.db2.gz	SVLNDFGPKHXXTM-UHFFFAOYSA-N	-1	0	345.761	3.793	10	0		EHAERM
Cc1cc2c(nc(-c3cccnc3)nc2N[C@@H](C(=O)[O-])C(C)C)s1	ZINC000072260824	216085600	/nfs/dbraw/zinc/08/56/00/216085600.db2.gz	IMUYWCGZNDUOGH-CYBMUJFWSA-N	-1	0	342.424	3.583	10	0		EHAERM
Cc1nc(C)c(C(=O)[O-])c(SCc2ccc(F)cc2Cl)n1	ZINC000022145549	212279150	/nfs/dbraw/zinc/27/91/50/212279150.db2.gz	APEADMZMJCPYIH-UHFFFAOYSA-N	-1	0	326.780	3.876	10	0		EHAERM
CCc1ccc(OCC(=O)Nc2sc3c(c2C(=O)[O-])CCC3)cc1	ZINC000020334723	212120548	/nfs/dbraw/zinc/12/05/48/212120548.db2.gz	RTFPHCZSAYLRDA-UHFFFAOYSA-N	-1	0	345.420	3.515	10	0		EHAERM
COc1cccc(C(=O)Nc2sc3c(c2C(=O)[O-])CCCCC3)c1	ZINC000020334836	212120474	/nfs/dbraw/zinc/12/04/74/212120474.db2.gz	ZIKGFJAEZZNKAB-UHFFFAOYSA-N	-1	0	345.420	3.976	10	0		EHAERM
Cc1nn(C)c(Oc2ccc(Cl)cc2)c1-c1noc(C)c1C(=O)[O-]	ZINC000536555947	564091435	/nfs/dbraw/zinc/09/14/35/564091435.db2.gz	IVWSXQZZKHVXOS-UHFFFAOYSA-N	-1	0	347.758	3.836	10	0		EHAERM
O=C([O-])c1cccc(CN2CCc3cc(Br)ccc32)c1	ZINC000713333802	955096395	/nfs/dbraw/zinc/09/63/95/955096395.db2.gz	XGEBCAXOOCPYCN-UHFFFAOYSA-N	-1	0	332.197	3.710	10	0		EHAERM
CC(C)C[C@@H](CNc1nc2cc(Br)ccc2o1)C(=O)[O-]	ZINC000705853755	977297416	/nfs/dbraw/zinc/29/74/16/977297416.db2.gz	LBULXRLNSUUBJR-VIFPVBQESA-N	-1	0	341.205	3.749	10	0		EHAERM
C[C@@H](c1ccc(C(=O)[O-])o1)N(C)Cc1cscc1Br	ZINC000709871249	977472974	/nfs/dbraw/zinc/47/29/74/977472974.db2.gz	SKQNPSINHWLCBZ-QMMMGPOBSA-N	-1	0	344.230	3.995	10	0		EHAERM
CCCc1cnc([N-]S(=O)(=O)/C=C\c2ccc(F)cc2)s1	ZINC000588387105	1016634702	/nfs/dbraw/zinc/63/47/02/1016634702.db2.gz	YVISXETZDSPFNU-HJWRWDBZSA-N	-1	0	326.418	3.647	10	0		EHAERM
C[C@@H]1OCCC[C@H]1C(=O)Nc1cc(Br)cc(Cl)c1[O-]	ZINC000276649413	1022051600	/nfs/dbraw/zinc/05/16/00/1022051600.db2.gz	CVVPHJNTCQPJBV-IONNQARKSA-N	-1	0	348.624	3.562	10	0		EHAERM
CC(C)[C@@H](C)CC(=O)N[C@H](CC(=O)[O-])c1ccc(Cl)c(F)c1	ZINC000236659272	1024062277	/nfs/dbraw/zinc/06/22/77/1024062277.db2.gz	MSSXTTXIULXWLP-IINYFYTJSA-N	-1	0	329.799	3.793	10	0		EHAERM
CC[C@@H](c1n[n-]c(=NC(=O)N2C[C@H]3CCC[C@@H]32)s1)c1ccccc1	ZINC000329943897	1024261394	/nfs/dbraw/zinc/26/13/94/1024261394.db2.gz	WMPLBAJQFHMOIQ-KFWWJZLASA-N	-1	0	342.468	3.518	10	0		EHAERM
Cc1ccc(-c2csc3ncnc(N[C@H](C)C(=O)[O-])c23)c(C)c1	ZINC000058279616	214525056	/nfs/dbraw/zinc/52/50/56/214525056.db2.gz	KDWLRRQJXALUIN-LLVKDONJSA-N	-1	0	327.409	3.860	10	0		EHAERM
O=C([O-])[C@H]1CCC[C@H](CC(=O)c2ccccc2Br)C1	ZINC000098090438	219083227	/nfs/dbraw/zinc/08/32/27/219083227.db2.gz	WWBDHSIOGABKMI-QWRGUYRKSA-N	-1	0	325.202	3.913	10	0		EHAERM
CCOc1ccccc1-c1cc(Nc2ccc(C(=O)[O-])cc2)ncn1	ZINC000049455567	214009535	/nfs/dbraw/zinc/00/95/35/214009535.db2.gz	HCBWJPQGUVBGMS-UHFFFAOYSA-N	-1	0	335.363	3.984	10	0		EHAERM
Cc1ccc2c(c1)c1c(n2C)C(=O)N([C@H](C)C(=O)[O-])[C@H]1c1ccccc1	ZINC000049453486	214009584	/nfs/dbraw/zinc/00/95/84/214009584.db2.gz	AKNQTRCMLLHIEI-ACJLOTCBSA-N	-1	0	348.402	3.505	10	0		EHAERM
COc1ccc(Cl)cc1Nc1ncnc2cc(C(=O)[O-])ccc21	ZINC000001293229	209723348	/nfs/dbraw/zinc/72/33/48/209723348.db2.gz	WLDBXWJZWKMVBA-UHFFFAOYSA-N	-1	0	329.743	3.734	10	0		EHAERM
Cc1cc(OCC(=O)Nc2cccc(C(=O)[O-])c2)cc(C(C)C)c1	ZINC000038820712	213226873	/nfs/dbraw/zinc/22/68/73/213226873.db2.gz	JLLZIZVOMDCFIT-UHFFFAOYSA-N	-1	0	327.380	3.834	10	0		EHAERM
O=C([O-])c1cc(-c2ccccc2F)nc2c(-c3ccccc3)cnn21	ZINC000036615721	213102551	/nfs/dbraw/zinc/10/25/51/213102551.db2.gz	OEENDOKNNIQAFO-UHFFFAOYSA-N	-1	0	333.322	3.901	10	0		EHAERM
CC(C)c1cc(N2CCCC[C@H]2C(=O)[O-])nc(-c2cccc(F)c2)n1	ZINC000070452158	215692919	/nfs/dbraw/zinc/69/29/19/215692919.db2.gz	UXNUHIPZVAGEES-INIZCTEOSA-N	-1	0	343.402	3.850	10	0		EHAERM
Cc1nn(-c2ccc(-c3noc(C4CCCC4)n3)cc2)cc1C(=O)[O-]	ZINC000032918286	212871302	/nfs/dbraw/zinc/87/13/02/212871302.db2.gz	RNSLCDMWBQIOOG-UHFFFAOYSA-N	-1	0	338.367	3.587	10	0		EHAERM
Nc1cc(Br)ccc1NC(=O)c1cc(Cl)ccc1[O-]	ZINC000020520829	212142099	/nfs/dbraw/zinc/14/20/99/212142099.db2.gz	FCJZDJDRKKOULT-UHFFFAOYSA-N	-1	0	341.592	3.643	10	0		EHAERM
C[C@@H]1CCc2c(sc(NC(=O)Cc3cccs3)c2C(=O)[O-])C1	ZINC000020333679	212120409	/nfs/dbraw/zinc/12/04/09/212120409.db2.gz	HXZRYWLVBYITMR-SECBINFHSA-N	-1	0	335.450	3.814	10	0		EHAERM
O=C([O-])c1c2ccccc2nc(-c2ccc(F)cc2)c1-n1cccn1	ZINC000011850181	211257243	/nfs/dbraw/zinc/25/72/43/211257243.db2.gz	ISVLZDLYDCHWRU-UHFFFAOYSA-N	-1	0	333.322	3.925	10	0		EHAERM
Cc1ccc(SCc2c(C(=O)[O-])nnn2-c2ccc(C)cc2)cc1	ZINC000011730483	211241413	/nfs/dbraw/zinc/24/14/13/211241413.db2.gz	NSNDIIUWZLUJEH-UHFFFAOYSA-N	-1	0	339.420	3.875	10	0		EHAERM
C[C@@H]1C[C@H](c2ccc(C(=O)[O-])cc2)CN1C(=O)OCc1ccccc1	ZINC000536959751	564091801	/nfs/dbraw/zinc/09/18/01/564091801.db2.gz	SSIXLCPGBPIJEO-KDOFPFPSSA-N	-1	0	339.391	3.899	10	0		EHAERM
C[C@@H]1C[C@@H](c2ccc(C(=O)[O-])cc2)CN1C(=O)OCc1ccccc1	ZINC000536959753	564091808	/nfs/dbraw/zinc/09/18/08/564091808.db2.gz	SSIXLCPGBPIJEO-RDTXWAMCSA-N	-1	0	339.391	3.899	10	0		EHAERM
O=C([O-])[C@@H]1CC[C@H](C(=O)Nc2cccc(Br)c2Cl)C1	ZINC000690851919	954678053	/nfs/dbraw/zinc/67/80/53/954678053.db2.gz	RSDWMQVKTAXZRR-JGVFFNPUSA-N	-1	0	346.608	3.542	10	0		EHAERM
C[C@@H](C(=O)Nc1cc(C(=O)[O-])ccc1Br)C1CCC1	ZINC000692696325	954707944	/nfs/dbraw/zinc/70/79/44/954707944.db2.gz	CRGAJOXAPPMEBD-MRVPVSSYSA-N	-1	0	326.190	3.522	10	0		EHAERM
O=C([O-])C1CCC(Nc2nc3cc(Br)ccc3o2)CC1	ZINC000705844610	969011865	/nfs/dbraw/zinc/01/18/65/969011865.db2.gz	HXOHGAACLCZAQP-UHFFFAOYSA-N	-1	0	339.189	3.646	10	0		EHAERM
O=C([O-])c1ccc(NCC2(CCOCc3ccccc3)CC2)nc1	ZINC000702217812	977070475	/nfs/dbraw/zinc/07/04/75/977070475.db2.gz	PNQFEJZPCIPQFS-UHFFFAOYSA-N	-1	0	326.396	3.579	10	0		EHAERM
O=C([O-])[C@H](c1ccccc1)N1Cc2ccc(Br)cc2C1	ZINC000707900232	977404198	/nfs/dbraw/zinc/40/41/98/977404198.db2.gz	VDRUPMWCBRWXFJ-HNNXBMFYSA-N	-1	0	332.197	3.591	10	0		EHAERM
Cc1oc(C(=O)[O-])cc1CN(C)Cc1cscc1Br	ZINC000709868429	977471715	/nfs/dbraw/zinc/47/17/15/977471715.db2.gz	HSOMTZVBWMYBQP-UHFFFAOYSA-N	-1	0	344.230	3.742	10	0		EHAERM
CN(Cc1csc(C(=O)[O-])c1)Cc1cscc1Br	ZINC000709906852	977472929	/nfs/dbraw/zinc/47/29/29/977472929.db2.gz	ZOJXINYXEPGUMV-UHFFFAOYSA-N	-1	0	346.271	3.902	10	0		EHAERM
Cc1oc(CN2Cc3cccc(Br)c3C2)cc1C(=O)[O-]	ZINC000713193056	977631286	/nfs/dbraw/zinc/63/12/86/977631286.db2.gz	HXEMHYDLKAFWRQ-UHFFFAOYSA-N	-1	0	336.185	3.565	10	0		EHAERM
C[C@H]1CC[C@@](C)(C(=O)[N-]S(=O)(=O)c2sccc2Cl)C1(C)C	ZINC000408502723	1019679207	/nfs/dbraw/zinc/67/92/07/1019679207.db2.gz	RGYKDNLIILFJRM-XPTSAGLGSA-N	-1	0	349.905	3.669	10	0		EHAERM
O=C([O-])c1cn(-c2c(Cl)cc(Br)cc2Cl)cn1	ZINC000050225935	214050665	/nfs/dbraw/zinc/05/06/65/214050665.db2.gz	AQCJUOUGVIWBTB-UHFFFAOYSA-N	-1	0	335.972	3.640	10	0		EHAERM
Cc1ccccc1[C@](O[C@@H]1CCCCN1C)(C(=O)[O-])c1ccccc1	ZINC000098089780	219083021	/nfs/dbraw/zinc/08/30/21/219083021.db2.gz	SSDWPUFYQALBIE-CTNGQTDRSA-N	-1	0	339.435	3.782	10	0		EHAERM
O=C([O-])c1ccccc1Nc1ccc(I)cc1	ZINC000039239149	213233124	/nfs/dbraw/zinc/23/31/24/213233124.db2.gz	SNVFNNUAERYXPC-UHFFFAOYSA-N	-1	0	339.132	3.733	10	0		EHAERM
Nc1ccc(Nc2ccc(Br)cc2F)c(C(=O)[O-])c1	ZINC000037930352	213175131	/nfs/dbraw/zinc/17/51/31/213175131.db2.gz	ZVORQWZJFXLKFC-UHFFFAOYSA-N	-1	0	325.137	3.612	10	0		EHAERM
CC(C)[C@@](C)(Cc1nc2cc(Br)ccc2[nH]1)C(=O)[O-]	ZINC000037441017	213146991	/nfs/dbraw/zinc/14/69/91/213146991.db2.gz	IRTMBNCGFSZYQS-CQSZACIVSA-N	-1	0	325.206	3.615	10	0		EHAERM
CC(C)[C@](C)(CC(=O)Nc1ccc(Br)cc1)C(=O)[O-]	ZINC000035125755	213009345	/nfs/dbraw/zinc/00/93/45/213009345.db2.gz	DVYGHPZUYOUHKF-AWEZNQCLSA-N	-1	0	328.206	3.525	10	0		EHAERM
Cc1cccc(-n2[n-]c3cc(=O)n(C4CCCCC4)c(C)c3c2=O)c1	ZINC000072445931	216235884	/nfs/dbraw/zinc/23/58/84/216235884.db2.gz	QXMDDCPVYFFGMY-UHFFFAOYSA-N	-1	0	337.423	3.603	10	0		EHAERM
CCc1cc2c(nc(C)nc2Nc2ccc(CC(=O)[O-])cc2)s1	ZINC000020326715	212119549	/nfs/dbraw/zinc/11/95/49/212119549.db2.gz	HWWDONBNDNYEOJ-UHFFFAOYSA-N	-1	0	327.409	3.933	10	0		EHAERM
O=C([O-])c1ccc2c(c1)C[C@H](c1ccc(Br)cc1)OC2=O	ZINC000011730333	211241899	/nfs/dbraw/zinc/24/18/99/211241899.db2.gz	HPRQZMIHVTXLTD-CQSZACIVSA-N	-1	0	347.164	3.602	10	0		EHAERM
Cc1ccc(SCc2c(C(=O)[O-])nnn2-c2ccc(F)cc2)cc1	ZINC000011730617	211241594	/nfs/dbraw/zinc/24/15/94/211241594.db2.gz	RMKNVOOBGXXNIB-UHFFFAOYSA-N	-1	0	343.383	3.705	10	0		EHAERM
O=C([O-])c1nc(-c2ccccc2Cl)n(-c2ccccc2Cl)n1	ZINC000045921397	258003672	/nfs/dbraw/zinc/00/36/72/258003672.db2.gz	QPQWMFICZRWICQ-UHFFFAOYSA-N	-1	0	334.162	3.939	10	0		EHAERM
CCN(CC)c1nc2nc(-c3cccs3)cc(C(=O)[O-])c2s1	ZINC000217015777	535688950	/nfs/dbraw/zinc/68/89/50/535688950.db2.gz	CLDKQJWICCXCIZ-UHFFFAOYSA-N	-1	0	333.438	3.964	10	0		EHAERM
C[C@H]1Cc2c(C(=O)[O-])c(I)sc2[C@@H](C)C1	ZINC000725246758	563976143	/nfs/dbraw/zinc/97/61/43/563976143.db2.gz	VXFZXGGJCCCYPC-RITPCOANSA-N	-1	0	336.194	3.737	10	0		EHAERM
CC1=CCC[C@H](C)[C@H]1C[C@@H](CNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000725245812	563976110	/nfs/dbraw/zinc/97/61/10/563976110.db2.gz	IEZHDBAGFIAKNW-SZMVWBNQSA-N	-1	0	345.439	3.996	10	0		EHAERM
CC(C)(C(=O)[O-])[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000253180574	564091725	/nfs/dbraw/zinc/09/17/25/564091725.db2.gz	DLZKRIOITNHCFC-INIZCTEOSA-N	-1	0	327.380	3.765	10	0		EHAERM
CC(C)(C)C1CCC(NC(=O)OCc2ccccc2)(C(=O)[O-])CC1	ZINC000226770809	564118261	/nfs/dbraw/zinc/11/82/61/564118261.db2.gz	NMJQFHXZGTVYTC-UHFFFAOYSA-N	-1	0	333.428	3.973	10	0		EHAERM
O=C([O-])c1cc(NC(=O)c2ccsc2Br)ccc1F	ZINC000698550658	976892533	/nfs/dbraw/zinc/89/25/33/976892533.db2.gz	IGHAQIWQZCQILX-UHFFFAOYSA-N	-1	0	344.161	3.600	10	0		EHAERM
O=C([O-])c1ccc(SCc2ncc(Br)s2)cc1	ZINC000713690071	977656928	/nfs/dbraw/zinc/65/69/28/977656928.db2.gz	ZBLCAKXNCJQPNM-UHFFFAOYSA-N	-1	0	330.228	3.896	10	0		EHAERM
O=C(c1cc(F)c(F)c([O-])c1F)N1CC=C(c2ccccc2)CC1	ZINC000184797109	1032335550	/nfs/dbraw/zinc/33/55/50/1032335550.db2.gz	BEAUJVALEBXVJE-UHFFFAOYSA-N	-1	0	333.309	3.739	10	0		EHAERM
C[C@@H](NC(=O)C1CCC(C(=O)[O-])CC1)c1ccc(C(F)(F)F)cc1	ZINC000194389096	1024409592	/nfs/dbraw/zinc/40/95/92/1024409592.db2.gz	JBPCLRLIIMXXDP-QFWMXSHPSA-N	-1	0	343.345	3.774	10	0		EHAERM
C[C@H](C(=O)N1C[C@H](C(=O)[O-])C[C@H](c2ccccc2)C1)c1cccs1	ZINC000245567123	1028855538	/nfs/dbraw/zinc/85/55/38/1028855538.db2.gz	RXRAUGYEPGZZKF-CWRNSKLLSA-N	-1	0	343.448	3.569	10	0		EHAERM
COc1ccc([C@H]2C[C@H](C)N(C(=O)c3cc(F)c([O-])c(F)c3)C2)cc1	ZINC000186823175	1035709543	/nfs/dbraw/zinc/70/95/43/1035709543.db2.gz	ZCQNEOJYQXVTNW-FZMZJTMJSA-N	-1	0	347.361	3.697	10	0		EHAERM
COc1ccc([C@@H]2C[C@H](C)N(C(=O)c3ccc(F)cc3[O-])C2)cc1	ZINC000123877362	1038092540	/nfs/dbraw/zinc/09/25/40/1038092540.db2.gz	FUYJVWMDRUAEIG-GXTWGEPZSA-N	-1	0	329.371	3.558	10	0		EHAERM
O=C([O-])CCC(=O)CCC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000040443168	213303535	/nfs/dbraw/zinc/30/35/35/213303535.db2.gz	BQZQELOCUXJDPB-UHFFFAOYSA-N	-1	0	326.348	3.876	10	0		EHAERM
Nc1cc(C(=O)[O-])ccc1Nc1ccc(F)cc1Br	ZINC000037930739	213174812	/nfs/dbraw/zinc/17/48/12/213174812.db2.gz	CNZJBVURAUIGOZ-UHFFFAOYSA-N	-1	0	325.137	3.612	10	0		EHAERM
CCN(Cc1ccc(Br)s1)C(=O)CCCCC(=O)[O-]	ZINC000037827772	213168268	/nfs/dbraw/zinc/16/82/68/213168268.db2.gz	JFPQRRWLEWVYRQ-UHFFFAOYSA-N	-1	0	348.262	3.504	10	0		EHAERM
O=C([O-])c1ccc(CN2C(=O)S/C(=C\c3ccccc3)C2=O)cc1	ZINC000026920277	212539953	/nfs/dbraw/zinc/53/99/53/212539953.db2.gz	UAWKUWALQWIRLT-GDNBJRDFSA-N	-1	0	339.372	3.621	10	0		EHAERM
Cc1cc(C)cc(O[C@H](C)C(=O)Nc2ccc(C(=O)[O-])cc2C)c1	ZINC000021026653	212200385	/nfs/dbraw/zinc/20/03/85/212200385.db2.gz	JNGFIUVIQCOKTE-CQSZACIVSA-N	-1	0	327.380	3.716	10	0		EHAERM
Cc1ccc(-c2csc3nc(C)nc(NCCC(=O)[O-])c23)cc1	ZINC000020316828	212118899	/nfs/dbraw/zinc/11/88/99/212118899.db2.gz	RGDZTKLDFINEPI-UHFFFAOYSA-N	-1	0	327.409	3.862	10	0		EHAERM
COc1ccc2c(c1)c1c(n2C(=O)c2ccccc2)CC[C@H](C(=O)[O-])C1	ZINC000000000574	208548504	/nfs/dbraw/zinc/54/85/04/208548504.db2.gz	ZNHCPKKNDKCPDG-AWEZNQCLSA-N	-1	0	349.386	3.528	10	0	in-man	EHAERM
CC(C)(C)OC(=O)NCC1(C(=O)[O-])CCC(c2ccccc2)CC1	ZINC000725244510	563975771	/nfs/dbraw/zinc/97/57/71/563975771.db2.gz	JACVADSYHGHQLS-UHFFFAOYSA-N	-1	0	333.428	3.940	10	0		EHAERM
CC[C@@H]1CCC[C@](CNC(=O)OCc2ccccc2)(C(=O)[O-])CC1	ZINC000725245879	563976084	/nfs/dbraw/zinc/97/60/84/563976084.db2.gz	YUNNBBOFSKYWMW-BEFAXECRSA-N	-1	0	333.428	3.974	10	0		EHAERM
O=C([O-])[C@H](CNC(=O)OCc1ccccc1)Cc1ccc(Cl)cc1	ZINC000380905271	564177686	/nfs/dbraw/zinc/17/76/86/564177686.db2.gz	YUYCEABGKAGIHG-HNNXBMFYSA-N	-1	0	347.798	3.510	10	0		EHAERM
Cc1cc(OCc2ccccc2)ccc1NC(=O)N[C@H](C)CC(=O)[O-]	ZINC000691053037	976346162	/nfs/dbraw/zinc/34/61/62/976346162.db2.gz	QQVGFHOGKGLDMY-CQSZACIVSA-N	-1	0	342.395	3.559	10	0		EHAERM
O=C([O-])CN(Cc1sccc1Br)Cc1ccccc1	ZINC000692438090	976478305	/nfs/dbraw/zinc/47/83/05/976478305.db2.gz	ZGKFJCWNWQIBMP-UHFFFAOYSA-N	-1	0	340.242	3.597	10	0		EHAERM
O=C([O-])c1cc(Br)ccc1OCc1ccc(Cl)cn1	ZINC000703922497	977210652	/nfs/dbraw/zinc/21/06/52/977210652.db2.gz	MPFJOASKDBNYMW-UHFFFAOYSA-N	-1	0	342.576	3.775	10	0		EHAERM
Cc1oc(C(=O)[O-])cc1CN1CCc2c1cccc2Br	ZINC000713308753	977632997	/nfs/dbraw/zinc/63/29/97/977632997.db2.gz	PMNDMRQAVFOWIH-UHFFFAOYSA-N	-1	0	336.185	3.611	10	0		EHAERM
C[C@H]1OCCC[C@H]1C(=O)Nc1cc(Br)cc(Cl)c1[O-]	ZINC000276649416	1022049995	/nfs/dbraw/zinc/04/99/95/1022049995.db2.gz	CVVPHJNTCQPJBV-VXNVDRBHSA-N	-1	0	348.624	3.562	10	0		EHAERM
O=C(NC[C@H]1CCOC2(CCC2)C1)c1ccc(Cl)c(Cl)c1[O-]	ZINC000333085884	1137954944	/nfs/dbraw/zinc/95/49/44/1137954944.db2.gz	NBKUYWBHJSVHBC-JTQLQIEISA-N	-1	0	344.238	3.778	10	0		EHAERM
CCC[C@@H](Nc1nc(C)nc2sc3c(c21)CC[C@H](C)C3)C(=O)[O-]	ZINC000058279798	214524520	/nfs/dbraw/zinc/52/45/20/214524520.db2.gz	HXUUUFHMCUXPAH-JOYOIKCWSA-N	-1	0	333.457	3.790	10	0		EHAERM
CC(C)(C)OC(=O)n1cc(C(=O)[O-])c2c1cccc2Br	ZINC000004291217	210161863	/nfs/dbraw/zinc/16/18/63/210161863.db2.gz	FVXWBZXXPWAIBN-UHFFFAOYSA-N	-1	0	340.173	3.885	10	0		EHAERM
O=C([O-])c1ccc(Cl)nc1NCc1ccccc1Br	ZINC000104179777	219356043	/nfs/dbraw/zinc/35/60/43/219356043.db2.gz	SWRASYKPCZOWLK-UHFFFAOYSA-N	-1	0	341.592	3.808	10	0		EHAERM
O=C([O-])COc1ccc(C(=O)c2ccc(Cl)o2)c(Cl)c1Cl	ZINC000001998338	209808896	/nfs/dbraw/zinc/80/88/96/209808896.db2.gz	DEFHRKSFURUDIU-UHFFFAOYSA-N	-1	0	349.553	3.934	10	0		EHAERM
[O-]c1c(Cl)c2c(c(Cl)c1Cl)O[C@H](Nc1ncccn1)C2	ZINC000039930418	213243320	/nfs/dbraw/zinc/24/33/20/213243320.db2.gz	HNIMAFWOIDLBIU-LURJTMIESA-N	-1	0	332.574	3.516	10	0		EHAERM
O=C([O-])C[C@H]1CCCCN1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000038026787	213192655	/nfs/dbraw/zinc/19/26/55/213192655.db2.gz	IMHFCBAXTYBNPG-SNVBAGLBSA-N	-1	0	331.199	3.855	10	0		EHAERM
Nc1cc([N-]S(=O)(=O)c2cc(Cl)sc2Cl)ccc1F	ZINC000036961625	213127143	/nfs/dbraw/zinc/12/71/43/213127143.db2.gz	BVBQAJNBVKJUIK-UHFFFAOYSA-N	-1	0	341.216	3.577	10	0		EHAERM
O=C([O-])Cc1csc2nc(-c3cc(Cl)ccc3Cl)cn12	ZINC000035382782	213025040	/nfs/dbraw/zinc/02/50/40/213025040.db2.gz	NORARIKUQWJSPZ-UHFFFAOYSA-N	-1	0	327.192	3.997	10	0		EHAERM
O=C([O-])c1cnc(Nc2cccc(Br)c2)c(Cl)c1	ZINC000019845055	212075693	/nfs/dbraw/zinc/07/56/93/212075693.db2.gz	JYJSWYFJIGOVKF-UHFFFAOYSA-N	-1	0	327.565	3.939	10	0		EHAERM
CC(C)(C)OC(=O)N1CCC(N(Cc2ccccc2)C(=O)[O-])CC1	ZINC000095080439	218274918	/nfs/dbraw/zinc/27/49/18/218274918.db2.gz	SPDLKNHCNQOMAF-UHFFFAOYSA-N	-1	0	334.416	3.566	10	0		EHAERM
CCc1nc(-c2ccc(C)cc2)nc(N2CCC[C@H](C(=O)[O-])C2)c1C	ZINC000073680172	135620001	/nfs/dbraw/zinc/62/00/01/135620001.db2.gz	JNRPCRJDLGSPEC-INIZCTEOSA-N	-1	0	339.439	3.624	10	0		EHAERM
O=C([O-])c1csc(-n2nc(-c3cccs3)cc2C(F)(F)F)n1	ZINC000005243173	563524023	/nfs/dbraw/zinc/52/40/23/563524023.db2.gz	WYPDLOINBPLFAQ-UHFFFAOYSA-N	-1	0	345.327	3.774	10	0		EHAERM
CC1=C[C@H](C)C[C@@H](C[C@@H](CNC(=O)OCc2ccccc2)C(=O)[O-])C1	ZINC000725246652	563976113	/nfs/dbraw/zinc/97/61/13/563976113.db2.gz	RRPQTOJEWJMDFK-QGTPRVQTSA-N	-1	0	345.439	3.996	10	0		EHAERM
COc1ccc(-c2csc3ncnc(S[C@H](C)C(=O)[O-])c23)cc1	ZINC000005414298	956873505	/nfs/dbraw/zinc/87/35/05/956873505.db2.gz	AJSHZEHCUQQNOA-SECBINFHSA-N	-1	0	346.433	3.932	10	0		EHAERM
O=C([O-])c1cc(COc2ccc(F)cc2Br)cs1	ZINC000689109710	976224593	/nfs/dbraw/zinc/22/45/93/976224593.db2.gz	XDZLAEPPLYITLI-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
O=C([O-])c1ccc(CNc2ncc(Cl)cc2Br)cc1	ZINC000707050232	977374484	/nfs/dbraw/zinc/37/44/84/977374484.db2.gz	MUFYJXGHIOGKJG-UHFFFAOYSA-N	-1	0	341.592	3.808	10	0		EHAERM
COc1cc(Br)ccc1NCc1cc(C(=O)[O-])oc1C	ZINC000712284600	977579410	/nfs/dbraw/zinc/57/94/10/977579410.db2.gz	FWLSNDVBQQPIGM-UHFFFAOYSA-N	-1	0	340.173	3.669	10	0		EHAERM
O=C([O-])[C@H](c1ccccc1)N1CCc2ccc(Br)cc21	ZINC000713324038	977633106	/nfs/dbraw/zinc/63/31/06/977633106.db2.gz	FZSFMOIXSIRYTN-HNNXBMFYSA-N	-1	0	332.197	3.638	10	0		EHAERM
C[C@H](COCc1ccccc1)CN1CCc2ccc(C(=O)[O-])cc21	ZINC000719495649	978005322	/nfs/dbraw/zinc/00/53/22/978005322.db2.gz	DZJRZYUZTNIAAE-HNNXBMFYSA-N	-1	0	325.408	3.600	10	0		EHAERM
O=C([O-])c1nc(C(=O)Nc2cc(Cl)c(F)c(Cl)c2)cs1	ZINC000721469024	978111337	/nfs/dbraw/zinc/11/13/37/978111337.db2.gz	ZFBGZXIJZQRDIQ-UHFFFAOYSA-N	-1	0	335.143	3.540	10	0		EHAERM
Cc1nn(-c2cccc(C)c2)c(-n2cccc2)c1CSCC(=O)[O-]	ZINC000049453578	214009269	/nfs/dbraw/zinc/00/92/69/214009269.db2.gz	MAUFHIYQGGZHCW-UHFFFAOYSA-N	-1	0	341.436	3.598	10	0		EHAERM
Cc1nc2ccc([N-]S(=O)(=O)c3cnc(Cl)s3)cc2s1	ZINC000037985859	213185045	/nfs/dbraw/zinc/18/50/45/213185045.db2.gz	SCDTVRJNRZOADQ-UHFFFAOYSA-N	-1	0	345.858	3.515	10	0		EHAERM
O=C([O-])c1cc(NC(=O)c2nc(Cl)ccc2Cl)ccc1Cl	ZINC000037985491	213183180	/nfs/dbraw/zinc/18/31/80/213183180.db2.gz	IBULUUTYYDPRBD-UHFFFAOYSA-N	-1	0	345.569	3.992	10	0		EHAERM
C[C@](NCC(F)(F)F)(C(=O)[O-])c1cc(F)c(Cl)cc1Cl	ZINC000037973303	213178027	/nfs/dbraw/zinc/17/80/27/213178027.db2.gz	PPOYWELMLFJNEX-SNVBAGLBSA-N	-1	0	334.096	3.584	10	0		EHAERM
CCCCCS(=O)(=O)c1cc(C(=O)[O-])c(Cl)cc1Cl	ZINC000037310479	213139360	/nfs/dbraw/zinc/13/93/60/213139360.db2.gz	MYIMBECEHMIEFG-UHFFFAOYSA-N	-1	0	325.213	3.656	10	0		EHAERM
Cc1cc(-n2nc(C(=O)[O-])c3c2CCCC3)ccc1Br	ZINC000022148450	212280478	/nfs/dbraw/zinc/28/04/78/212280478.db2.gz	BVTPSQHZBDGVRX-UHFFFAOYSA-N	-1	0	335.201	3.520	10	0		EHAERM
O=C([O-])c1nn(-c2cccc(Br)c2)c2c1CCCCC2	ZINC000021955879	212266676	/nfs/dbraw/zinc/26/66/76/212266676.db2.gz	GPLWVNZGBMFFHC-UHFFFAOYSA-N	-1	0	335.201	3.602	10	0		EHAERM
Cc1sc2nc(C)nc(Nc3ccc(CC(=O)[O-])cc3)c2c1C	ZINC000020326675	212119613	/nfs/dbraw/zinc/11/96/13/212119613.db2.gz	IQHDSFMGZMAJFI-UHFFFAOYSA-N	-1	0	327.409	3.987	10	0		EHAERM
Cc1sc2ncnc(N3CCC[C@H]3C(=O)[O-])c2c1-c1ccccc1	ZINC000020317998	212118989	/nfs/dbraw/zinc/11/89/89/212118989.db2.gz	NWCFRJCMVLMASF-ZDUSSCGKSA-N	-1	0	339.420	3.720	10	0		EHAERM
O=C([O-])c1cnc(Oc2cccc(Br)c2)c(Cl)c1	ZINC000019505933	212034718	/nfs/dbraw/zinc/03/47/18/212034718.db2.gz	KAIWRJFRKNYGDS-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
CN(Cc1csc(Br)c1)c1ccc(C(=O)[O-])cc1F	ZINC000042362804	213498516	/nfs/dbraw/zinc/49/85/16/213498516.db2.gz	QBDXPABKOJDGBV-UHFFFAOYSA-N	-1	0	344.205	3.984	10	0		EHAERM
Cc1c(Br)c(C(F)(F)F)nn1-c1ccc(C(=O)[O-])cc1	ZINC000026439162	525523417	/nfs/dbraw/zinc/52/34/17/525523417.db2.gz	LZVLYJROJRTUNI-UHFFFAOYSA-N	-1	0	349.106	3.660	10	0		EHAERM
CC1=C[C@H](C)C[C@H](C[C@@H](CNC(=O)OCc2ccccc2)C(=O)[O-])C1	ZINC000725246653	563976120	/nfs/dbraw/zinc/97/61/20/563976120.db2.gz	RRPQTOJEWJMDFK-WBAXXEDZSA-N	-1	0	345.439	3.996	10	0		EHAERM
C[C@H]1Cc2c(sc(I)c2C(=O)[O-])[C@H](C)C1	ZINC000725246757	563976161	/nfs/dbraw/zinc/97/61/61/563976161.db2.gz	VXFZXGGJCCCYPC-PHDIDXHHSA-N	-1	0	336.194	3.737	10	0		EHAERM
CCOc1cc(/C=C\C(=O)[O-])ccc1OCCOc1ccc(F)cc1	ZINC000006234105	564083153	/nfs/dbraw/zinc/08/31/53/564083153.db2.gz	FAHGSYHYYHTIGB-WMZJFQQLSA-N	-1	0	346.354	3.780	10	0		EHAERM
CC[C@]1(C(=O)[O-])C[C@@H](C2CC2)C[C@@H]1NC(=O)OCc1ccccc1	ZINC000685958785	564177071	/nfs/dbraw/zinc/17/70/71/564177071.db2.gz	GOYWLRYGLZWYEK-BXWFABGCSA-N	-1	0	331.412	3.582	10	0		EHAERM
O=C([O-])c1cccc(CNc2cccc(Br)c2Cl)n1	ZINC000690750379	976331238	/nfs/dbraw/zinc/33/12/38/976331238.db2.gz	JASHIYHTEXTRES-UHFFFAOYSA-N	-1	0	341.592	3.808	10	0		EHAERM
O=C([O-])c1csc(COc2ccc(F)cc2Br)c1	ZINC000711424534	977546898	/nfs/dbraw/zinc/54/68/98/977546898.db2.gz	POKINCILLPMIHG-UHFFFAOYSA-N	-1	0	331.162	3.927	10	0		EHAERM
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(Br)c(C(=O)[O-])c1	ZINC000714401683	977671641	/nfs/dbraw/zinc/67/16/41/977671641.db2.gz	KQGASPQURPZBIZ-MWLCHTKSSA-N	-1	0	340.217	3.912	10	0		EHAERM
CC(C)C(C)(C)C(=O)[N-]S(=O)(=O)c1cc(Cl)sc1Cl	ZINC000408486069	1019622196	/nfs/dbraw/zinc/62/21/96/1019622196.db2.gz	IRPCZCJUACSZRX-UHFFFAOYSA-N	-1	0	344.285	3.542	10	0		EHAERM
C[C@H]1C[C@H](C(=O)[N-]S(=O)(=O)c2sccc2Cl)CC(C)(C)C1	ZINC000408497770	1019660091	/nfs/dbraw/zinc/66/00/91/1019660091.db2.gz	MDACOPGREFBGPJ-UWVGGRQHSA-N	-1	0	349.905	3.669	10	0		EHAERM
CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2cc(F)c(F)cc2F)c1	ZINC000105591930	1037217822	/nfs/dbraw/zinc/21/78/22/1037217822.db2.gz	PRRAPKRFLBXPHT-VIFPVBQESA-N	-1	0	345.342	3.612	10	0		EHAERM
CC(C)(C)SCC(=O)N[C@@H](CC(=O)[O-])c1ccc(Cl)c(F)c1	ZINC000236592925	1039225083	/nfs/dbraw/zinc/22/50/83/1039225083.db2.gz	MZPFFMQGHHORRY-LBPRGKRZSA-N	-1	0	347.839	3.643	10	0		EHAERM
O=C([O-])c1ccc(Nc2c3c([nH+]c4ccc(C(=O)[O-])cc42)CCC3)cc1	ZINC000004226665	210146577	/nfs/dbraw/zinc/14/65/77/210146577.db2.gz	NRKSKMMVZZJPQJ-UHFFFAOYSA-N	-1	0	348.358	3.864	10	0		EHAERM
Cc1ccc(F)c(Nc2ncc(Br)cc2C(=O)[O-])c1	ZINC000104185489	219357262	/nfs/dbraw/zinc/35/72/62/219357262.db2.gz	QCQUXXQSWMWKIM-UHFFFAOYSA-N	-1	0	325.137	3.733	10	0		EHAERM
O=C([O-])c1cccnc1C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000040803881	213388145	/nfs/dbraw/zinc/38/81/45/213388145.db2.gz	PUWCRUCKVNUMCB-UHFFFAOYSA-N	-1	0	334.331	3.824	10	0		EHAERM
Cc1ccc(Oc2ncnc(Nc3ccc(C(=O)[O-])cc3)c2N)cc1	ZINC000040796346	213386958	/nfs/dbraw/zinc/38/69/58/213386958.db2.gz	ATDPYYDNCZHQQB-UHFFFAOYSA-N	-1	0	336.351	3.601	10	0		EHAERM
Cc1cccc(Nc2nc(OCC(=O)[O-])cc(-c3ccccc3)n2)c1C	ZINC000073697042	216413266	/nfs/dbraw/zinc/41/32/66/216413266.db2.gz	SBIWGVQFNJWYBY-UHFFFAOYSA-N	-1	0	349.390	3.967	10	0		EHAERM
Cc1sc(NC(=O)[C@@H]2CCCO2)c(C(=O)[O-])c1-c1ccccc1	ZINC000020334394	212120580	/nfs/dbraw/zinc/12/05/80/212120580.db2.gz	RIDUPSUZWPMBSD-LBPRGKRZSA-N	-1	0	331.393	3.539	10	0		EHAERM
COCc1cc(Nc2cccc(C(=O)[O-])c2)nc(-c2ccccc2)n1	ZINC000045947196	258003722	/nfs/dbraw/zinc/00/37/22/258003722.db2.gz	AFQXOEBTWCDDNE-UHFFFAOYSA-N	-1	0	335.363	3.732	10	0		EHAERM
CCCC1CCN(c2ncc(Br)cc2C(=O)[O-])CC1	ZINC000050906550	132179953	/nfs/dbraw/zinc/17/99/53/132179953.db2.gz	OQXXLXXBISZXPA-UHFFFAOYSA-N	-1	0	327.222	3.559	10	0		EHAERM
CC1(C)CCc2c(sc(I)c2C(=O)[O-])C1	ZINC000725246681	563976149	/nfs/dbraw/zinc/97/61/49/563976149.db2.gz	SQXWUWNYBAXQJU-UHFFFAOYSA-N	-1	0	336.194	3.566	10	0		EHAERM
O=C([O-])CC[C@H]1Cc2ccccc2N(C(=O)OCc2ccccc2)C1	ZINC000669380091	564084346	/nfs/dbraw/zinc/08/43/46/564084346.db2.gz	ILFOKKXJJSZPDY-INIZCTEOSA-N	-1	0	339.391	3.867	10	0		EHAERM
O=C([O-])c1coc(CNc2cc(F)c(Br)c(F)c2)c1	ZINC000689665571	976260315	/nfs/dbraw/zinc/26/03/15/976260315.db2.gz	LGDLBGHYXIWZMU-UHFFFAOYSA-N	-1	0	332.100	3.631	10	0		EHAERM
C[C@H](C(=O)Nc1ccc(Br)cc1C(=O)[O-])C1CCC1	ZINC000692698467	976537152	/nfs/dbraw/zinc/53/71/52/976537152.db2.gz	LXHGMJHCCKFORN-QMMMGPOBSA-N	-1	0	326.190	3.522	10	0		EHAERM
Cc1oc(COc2cc(C)ccc2Br)cc1C(=O)[O-]	ZINC000699663177	976927322	/nfs/dbraw/zinc/92/73/22/976927322.db2.gz	LMXJRFRVWDYUAI-UHFFFAOYSA-N	-1	0	325.158	3.936	10	0		EHAERM
Cc1nc(NCC2(CCOCc3ccccc3)CC2)ccc1C(=O)[O-]	ZINC000702220287	977071214	/nfs/dbraw/zinc/07/12/14/977071214.db2.gz	AZSUQODJUBQPFT-UHFFFAOYSA-N	-1	0	340.423	3.887	10	0		EHAERM
C[C@H]1CCCC[C@H]1C(=O)Nc1ccc(Br)c(C(=O)[O-])c1	ZINC000714401681	977671673	/nfs/dbraw/zinc/67/16/73/977671673.db2.gz	KQGASPQURPZBIZ-GXSJLCMTSA-N	-1	0	340.217	3.912	10	0		EHAERM
O=C([O-])c1cncc(COc2ccc(Cl)cc2Br)c1	ZINC000721568612	978119430	/nfs/dbraw/zinc/11/94/30/978119430.db2.gz	UWYCXRVCRCEGHQ-UHFFFAOYSA-N	-1	0	342.576	3.775	10	0		EHAERM
O=C(c1cc(F)c([O-])c(Cl)c1)N1CCC[C@@H](c2nccs2)C1	ZINC000184409684	1032267679	/nfs/dbraw/zinc/26/76/79/1032267679.db2.gz	QAENZZZTFDISMB-SECBINFHSA-N	-1	0	340.807	3.661	10	0		EHAERM
O=C(NCc1ccc(O)c(F)c1)N1CC=C(c2cccs2)CC1	ZINC000163785967	1022656093	/nfs/dbraw/zinc/65/60/93/1022656093.db2.gz	LLOSDVTYOUFVNS-UHFFFAOYSA-N	-1	0	332.400	3.592	10	0		EHAERM
CCc1onc(C)c1[N-]S(=O)(=O)c1cc(Cl)c(C)c(Cl)c1	ZINC000134753639	1024152785	/nfs/dbraw/zinc/15/27/85/1024152785.db2.gz	XMGAMWIZMCNJLE-UHFFFAOYSA-N	-1	0	349.239	3.961	10	0		EHAERM
O=C(NC1CCN(c2cccs2)CC1)c1ccc([O-])c(Cl)c1	ZINC000153410999	1027842677	/nfs/dbraw/zinc/84/26/77/1027842677.db2.gz	LGQDEANTXHAOPY-UHFFFAOYSA-N	-1	0	336.844	3.506	10	0		EHAERM
Cc1ccc(-c2cc(C([O-])=CC(=O)c3cc(F)ccc3O)no2)cc1	ZINC000100754701	219105708	/nfs/dbraw/zinc/10/57/08/219105708.db2.gz	WFYPIALUNRFJCW-UHFFFAOYSA-N	-1	0	339.322	3.950	10	0		EHAERM
CCCOc1ccccc1/C=C/C(=O)Nc1ccccc1C(=O)[O-]	ZINC000064873463	214812393	/nfs/dbraw/zinc/81/23/93/214812393.db2.gz	JOWSAFLZBRNHSC-VAWYXSNFSA-N	-1	0	325.364	3.826	10	0		EHAERM
CCCN(CCC)c1ncc(NC(=O)c2ccccc2)cc1C(=O)[O-]	ZINC000064978541	214818761	/nfs/dbraw/zinc/81/87/61/214818761.db2.gz	AHSGCYLKAPALFC-UHFFFAOYSA-N	-1	0	341.411	3.659	10	0		EHAERM
Cc1ccc(-c2csc3[nH]c(S[C@H](C)C(=O)[O-])nc(=O)c23)cc1	ZINC000001290356	209722154	/nfs/dbraw/zinc/72/21/54/209722154.db2.gz	CUDVNYWSJCGRFX-SECBINFHSA-N	-1	0	346.433	3.525	10	0		EHAERM
COc1cc(Cl)c(C)cc1[N-]S(=O)(=O)c1ccnc(Cl)c1	ZINC000038008496	213188147	/nfs/dbraw/zinc/18/81/47/213188147.db2.gz	HQQHWQQBBWLYJZ-UHFFFAOYSA-N	-1	0	347.223	3.506	10	0		EHAERM
Cc1cc(-c2cc(S(=O)(=O)[N-]c3ccc(F)c(C)c3)c(C)o2)n[nH]1	ZINC000075519158	216627943	/nfs/dbraw/zinc/62/79/43/216627943.db2.gz	AHDRPNSHRZAQPE-UHFFFAOYSA-N	-1	0	349.387	3.535	10	0		EHAERM
Cc1sc(NC(=O)CC(C)C)nc1-c1ccc(OCC(=O)[O-])cc1	ZINC000020340548	212120416	/nfs/dbraw/zinc/12/04/16/212120416.db2.gz	QHYKJMQODHIRQM-UHFFFAOYSA-N	-1	0	348.424	3.567	10	0		EHAERM
O=C([O-])c1nc2ccc(Br)cc2c(-c2ccccc2)n1	ZINC000091692478	218048905	/nfs/dbraw/zinc/04/89/05/218048905.db2.gz	IITGAKWBXPRMGX-UHFFFAOYSA-N	-1	0	329.153	3.758	10	0		EHAERM
Cc1ccc(CN2c3ccccc3S/C(=C\C(=O)[O-])C2=O)cc1	ZINC000021145996	135723471	/nfs/dbraw/zinc/72/34/71/135723471.db2.gz	IWEUVOPNTOTXEU-YBEGLDIGSA-N	-1	0	325.389	3.602	10	0		EHAERM
C[C@@H]1C[C@H](C)Cc2c1sc(I)c2C(=O)[O-]	ZINC000725246756	563976165	/nfs/dbraw/zinc/97/61/65/563976165.db2.gz	VXFZXGGJCCCYPC-NTSWFWBYSA-N	-1	0	336.194	3.737	10	0		EHAERM
O=C([O-])c1ccc(-c2ccc(Br)nc2)c(OC(F)F)c1	ZINC000725241834	563974987	/nfs/dbraw/zinc/97/49/87/563974987.db2.gz	RRLMPDFUKNVNAT-UHFFFAOYSA-N	-1	0	344.111	3.811	10	0		EHAERM
O=C([O-])[C@@H](CNC(=O)OCc1ccccc1)CC1CCCCCC1	ZINC000725246893	563976155	/nfs/dbraw/zinc/97/61/55/563976155.db2.gz	ZYXODXBSYBPSIO-QGZVFWFLSA-N	-1	0	333.428	3.974	10	0		EHAERM
CC(C)(C)OC(=O)N[C@@H](CCc1ccc2ccccc2c1)C(=O)[O-]	ZINC000095749297	563977674	/nfs/dbraw/zinc/97/76/74/563977674.db2.gz	RBGNOZINYUCSMY-INIZCTEOSA-N	-1	0	329.396	3.750	10	0		EHAERM
CCOc1cc(/C=C\C(=O)[O-])ccc1OCCOc1ccccc1	ZINC000006234112	564083144	/nfs/dbraw/zinc/08/31/44/564083144.db2.gz	SFOZXAJMWIBUNF-LUAWRHEFSA-N	-1	0	328.364	3.641	10	0		EHAERM
O=C([O-])c1sc(NC(=O)OCc2ccccc2)nc1C(F)(F)F	ZINC000536953500	564091759	/nfs/dbraw/zinc/09/17/59/564091759.db2.gz	IOIZZKRJZLKUBU-UHFFFAOYSA-N	-1	0	346.286	3.609	10	0		EHAERM
O=C([O-])[C@@H](Nc1cc(F)c(Br)c(F)c1)c1ccccc1	ZINC000689664850	976260358	/nfs/dbraw/zinc/26/03/58/976260358.db2.gz	NQTWWRXEMULOQO-ZDUSSCGKSA-N	-1	0	342.139	3.965	10	0		EHAERM
O=C([O-])CN(Cc1ccccc1)C(=O)c1ccc(F)c2ccccc12	ZINC000692406157	976446867	/nfs/dbraw/zinc/44/68/67/976446867.db2.gz	YCXFPPGLFOOHAY-UHFFFAOYSA-N	-1	0	337.350	3.706	10	0		EHAERM
Cc1c(F)c(Br)ccc1NCc1ccc(C(=O)[O-])cn1	ZINC000694037938	976663860	/nfs/dbraw/zinc/66/38/60/976663860.db2.gz	XYILKSFCDNQFTJ-UHFFFAOYSA-N	-1	0	339.164	3.602	10	0		EHAERM
O=C([O-])CCCCCNc1nc2cc(Br)ccc2o1	ZINC000705872301	977298672	/nfs/dbraw/zinc/29/86/72/977298672.db2.gz	ILDQNVSDRRIEON-UHFFFAOYSA-N	-1	0	327.178	3.647	10	0		EHAERM
COc1ccc(OCc2cc(C(=O)[O-])cs2)c(Br)c1	ZINC000711435968	977547832	/nfs/dbraw/zinc/54/78/32/977547832.db2.gz	XXOBNXMOLZRHSE-UHFFFAOYSA-N	-1	0	343.198	3.796	10	0		EHAERM
O=C([O-])c1sccc1CN1Cc2cccc(Br)c2C1	ZINC000713197016	977631120	/nfs/dbraw/zinc/63/11/20/977631120.db2.gz	YOUPAMWYWZXIJN-UHFFFAOYSA-N	-1	0	338.226	3.725	10	0		EHAERM
C[C@H]1C[C@@H](C(=O)[N-]S(=O)(=O)c2sccc2Cl)CC(C)(C)C1	ZINC000408497773	1019660213	/nfs/dbraw/zinc/66/02/13/1019660213.db2.gz	MDACOPGREFBGPJ-VHSXEESVSA-N	-1	0	349.905	3.669	10	0		EHAERM
O=C([O-])[C@@H]1C[C@@H](c2ccccc2)CN(C(=O)c2cc3ccccc3o2)C1	ZINC000180308981	1031877314	/nfs/dbraw/zinc/87/73/14/1031877314.db2.gz	RUXKOGIQHQEHRA-IAGOWNOFSA-N	-1	0	349.386	3.763	10	0		EHAERM
CSc1ccccc1[N-]S(=O)(=O)c1cccc2ncccc21	ZINC000102319719	1036230729	/nfs/dbraw/zinc/23/07/29/1036230729.db2.gz	VLQWHHWKPGPLDU-UHFFFAOYSA-N	-1	0	330.434	3.758	10	0		EHAERM
CC(=O)c1cc(Br)ccc1OCc1ccc(C(=O)[O-])cc1	ZINC000105662000	1127993349	/nfs/dbraw/zinc/99/33/49/1127993349.db2.gz	YSCFYTQOMYNHEL-UHFFFAOYSA-N	-1	0	349.180	3.929	10	0		EHAERM
CC(C)n1c2ccccc2c2c1C(=O)N(CC(=O)[O-])[C@H]2c1ccccc1	ZINC000049453494	214009457	/nfs/dbraw/zinc/00/94/57/214009457.db2.gz	MIUOOCMNHZLIHH-IBGZPJMESA-N	-1	0	348.402	3.852	10	0		EHAERM
O=C([O-])c1ccc(F)cc1-c1ccc(C(=O)N2CCCCC2)cc1	ZINC000065355330	214873975	/nfs/dbraw/zinc/87/39/75/214873975.db2.gz	ZTGQHOQZSXXVAT-UHFFFAOYSA-N	-1	0	327.355	3.817	10	0		EHAERM
CCCCN(C)c1ccc(NC(=O)c2cccs2)cc1C(=O)[O-]	ZINC000046053312	213777793	/nfs/dbraw/zinc/77/77/93/213777793.db2.gz	PWXHIPVLXIPKRN-UHFFFAOYSA-N	-1	0	332.425	3.935	10	0		EHAERM
Cc1cc(F)ccc1NCc1cc(C(=O)[O-])cc(-c2ccncc2)n1	ZINC000040896342	213398678	/nfs/dbraw/zinc/39/86/78/213398678.db2.gz	DWBDEZKCGZOAAR-UHFFFAOYSA-N	-1	0	337.354	3.901	10	0		EHAERM
CCCc1cc(Nc2cccc(C(=O)[O-])c2)nc(-c2ccncc2)n1	ZINC000070455716	215693844	/nfs/dbraw/zinc/69/38/44/215693844.db2.gz	ASSRPLIBKVBOMG-UHFFFAOYSA-N	-1	0	334.379	3.933	10	0		EHAERM
CC(C)c1ccc(C(=O)CC(=O)Nc2cccc(C(=O)[O-])c2)cc1	ZINC000090624657	217946363	/nfs/dbraw/zinc/94/63/63/217946363.db2.gz	DBIPDSRTKGHNNJ-UHFFFAOYSA-N	-1	0	325.364	3.720	10	0		EHAERM
O=C([O-])c1c2ccccc2nn1C(=O)c1ccc(Cl)cc1Cl	ZINC000090485311	217933008	/nfs/dbraw/zinc/93/30/08/217933008.db2.gz	QEULATHMPCMXCF-UHFFFAOYSA-N	-1	0	335.146	3.730	10	0		EHAERM
CCC[C@@H]1CN(c2ccccc2C(=O)[O-])CCN1C(=O)OC(C)(C)C	ZINC000039952681	132398004	/nfs/dbraw/zinc/39/80/04/132398004.db2.gz	FIUBNVYUHJEYRE-CQSZACIVSA-N	-1	0	348.443	3.611	10	0		EHAERM
Cc1c(C(=O)[O-])oc2c1-c1nn(Cc3cccc(Cl)c3)cc1CC2	ZINC000006751401	563585293	/nfs/dbraw/zinc/58/52/93/563585293.db2.gz	KBRXGXFBJJGGHB-UHFFFAOYSA-N	-1	0	342.782	3.950	10	0		EHAERM
CC1=CCC[C@H](C)[C@@H]1C[C@@H](CNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000725245811	563976134	/nfs/dbraw/zinc/97/61/34/563976134.db2.gz	IEZHDBAGFIAKNW-RYQLBKOJSA-N	-1	0	345.439	3.996	10	0		EHAERM
COc1ccc2c(c1)[C@H](CC(=O)[O-])C[C@H](C)N2C(=O)OC(C)(C)C	ZINC000725253852	563982249	/nfs/dbraw/zinc/98/22/49/563982249.db2.gz	MNUJRSOIYMIYMH-RYUDHWBXSA-N	-1	0	335.400	3.787	10	0		EHAERM
O=C([O-])[C@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1C1CCCCC1	ZINC000675051658	564111792	/nfs/dbraw/zinc/11/17/92/564111792.db2.gz	WMAJPAILSVYFNE-SJORKVTESA-N	-1	0	331.412	3.536	10	0		EHAERM
O=C([O-])[C@@H]1CN(C(=O)OCc2ccccc2)C[C@@H]1C1CCCCC1	ZINC000675051656	564111793	/nfs/dbraw/zinc/11/17/93/564111793.db2.gz	WMAJPAILSVYFNE-IAGOWNOFSA-N	-1	0	331.412	3.536	10	0		EHAERM
C[C@@H]1CCc2c(C(=O)N(CC(=O)[O-])Cc3ccccc3)csc2C1	ZINC000692405399	976446567	/nfs/dbraw/zinc/44/65/67/976446567.db2.gz	TZZMDWHETRQIHA-CYBMUJFWSA-N	-1	0	343.448	3.600	10	0		EHAERM
Cc1csc(C(=O)N(CCC(=O)[O-])Cc2ccccc2)c1Cl	ZINC000692445077	976481553	/nfs/dbraw/zinc/48/15/53/976481553.db2.gz	LTXODCPDSXOJAL-UHFFFAOYSA-N	-1	0	337.828	3.827	10	0		EHAERM
O=C([O-])CN(Cc1ncc(-c2ccc(F)cc2)o1)Cc1ccccc1	ZINC000701413001	977011264	/nfs/dbraw/zinc/01/12/64/977011264.db2.gz	LPGOKMSIJDWTNI-UHFFFAOYSA-N	-1	0	340.354	3.568	10	0		EHAERM
C[C@@H]1C[C@H](C(=O)[O-])CCN1Cc1cccc(Br)c1Cl	ZINC000706449386	977325679	/nfs/dbraw/zinc/32/56/79/977325679.db2.gz	VATXXUXTENGVCB-NXEZZACHSA-N	-1	0	346.652	3.788	10	0		EHAERM
Cc1cccc2[nH]cc(CCNC(=O)c3ccc([O-])c(Cl)c3)c21	ZINC000103205056	1026056463	/nfs/dbraw/zinc/05/64/63/1026056463.db2.gz	HYISYQJUHTYINA-UHFFFAOYSA-N	-1	0	328.799	3.808	10	0		EHAERM
CC(C)(C)c1nc(CO[N-]C(=O)C(C)(C)c2ccccc2)cs1	ZINC000104054085	1135747290	/nfs/dbraw/zinc/74/72/90/1135747290.db2.gz	PLLCPFJMZSBOSR-UHFFFAOYSA-N	-1	0	332.469	3.966	10	0		EHAERM
CN(c1cccc(C(=O)[O-])c1)c1nc(Cl)nc(Cl)c1Cl	ZINC000098180819	219086781	/nfs/dbraw/zinc/08/67/81/219086781.db2.gz	KJQLRIKLQNFPDA-UHFFFAOYSA-N	-1	0	332.574	3.903	10	0		EHAERM
O=C([O-])c1cc(-c2ccccn2)nc2c(Br)cccc12	ZINC000003756624	210073278	/nfs/dbraw/zinc/07/32/78/210073278.db2.gz	KMLFLQLAZZXKMA-UHFFFAOYSA-N	-1	0	329.153	3.758	10	0		EHAERM
CCCN(CC(=O)[O-])C(=O)CCCSc1ccc(Cl)cc1	ZINC000038019801	213191815	/nfs/dbraw/zinc/19/18/15/213191815.db2.gz	WDDFSHPDNIATPW-UHFFFAOYSA-N	-1	0	329.849	3.536	10	0		EHAERM
CCc1c(C)nc(-c2ccncc2)nc1Oc1ccc(C(=O)[O-])cc1	ZINC000073682593	216411891	/nfs/dbraw/zinc/41/18/91/216411891.db2.gz	MSOMHZVXYUEBJJ-UHFFFAOYSA-N	-1	0	335.363	3.900	10	0		EHAERM
O=C([O-])C[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc(F)cc1F	ZINC000021044506	212203677	/nfs/dbraw/zinc/20/36/77/212203677.db2.gz	QYZLYENDMGZHJU-MRXNPFEDSA-N	-1	0	346.333	3.571	10	0		EHAERM
O=C([O-])c1c(NC(=O)/C=C/c2ccc(F)cc2)sc2c1CCC2	ZINC000020334753	212120377	/nfs/dbraw/zinc/12/03/77/212120377.db2.gz	SMBSNEWXVLCRIU-RMKNXTFCSA-N	-1	0	331.368	3.726	10	0		EHAERM
Cc1ccc(SCc2c(C(=O)[O-])nnn2-c2ccccc2)cc1	ZINC000011730451	211242328	/nfs/dbraw/zinc/24/23/28/211242328.db2.gz	RCMCNIWIGWVNDA-UHFFFAOYSA-N	-1	0	325.393	3.566	10	0		EHAERM
CCC[C@H]1CN(c2ccccc2C(=O)[O-])CCN1C(=O)OC(C)(C)C	ZINC000039952686	132398476	/nfs/dbraw/zinc/39/84/76/132398476.db2.gz	FIUBNVYUHJEYRE-AWEZNQCLSA-N	-1	0	348.443	3.611	10	0		EHAERM
Cc1ccc(/C=C2/Sc3ccc(C(=O)[O-])cc3N(C)C2=O)cc1	ZINC000049453055	132430928	/nfs/dbraw/zinc/43/09/28/132430928.db2.gz	DMZCHXNXCVGDJT-CXUHLZMHSA-N	-1	0	325.389	3.803	10	0		EHAERM
CC(C)(C)OC(=O)NOC1(CC(=O)[O-])CC(C)(C)CC(C)(C)C1	ZINC000675054669	564084134	/nfs/dbraw/zinc/08/41/34/564084134.db2.gz	OXCFGQUFLFQSJZ-UHFFFAOYSA-N	-1	0	329.437	3.893	10	0		EHAERM
CCN(CC)c1ncc(NC(=O)c2cccc(Cl)c2)cc1C(=O)[O-]	ZINC000064978754	564098865	/nfs/dbraw/zinc/09/88/65/564098865.db2.gz	AFAZXWWKEOKJCX-UHFFFAOYSA-N	-1	0	347.802	3.532	10	0		EHAERM
CC1(C)CC(C)(C)CC(NC(=O)OCc2ccccc2)(C(=O)[O-])C1	ZINC000227143171	564118257	/nfs/dbraw/zinc/11/82/57/564118257.db2.gz	PONSOTWOJHRVSO-UHFFFAOYSA-N	-1	0	333.428	3.973	10	0		EHAERM
O=C([O-])[C@@H](CNC(=O)OCc1ccccc1)Cc1ccc(Cl)cc1	ZINC000380905272	564177707	/nfs/dbraw/zinc/17/77/07/564177707.db2.gz	YUYCEABGKAGIHG-OAHLLOKOSA-N	-1	0	347.798	3.510	10	0		EHAERM
Cc1oc(C(=O)[O-])cc1C(=O)Nc1cccc(C)c1Br	ZINC000689115388	976225943	/nfs/dbraw/zinc/22/59/43/976225943.db2.gz	AENLICWWTWVCKH-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
O=C([O-])c1ccc(Br)cc1NC(=O)[C@@H]1CCC[C@H]2C[C@H]21	ZINC000694351546	976691926	/nfs/dbraw/zinc/69/19/26/976691926.db2.gz	WFGCPUKBVIEPAM-MKPLZMMCSA-N	-1	0	338.201	3.522	10	0		EHAERM
O=C([O-])c1ccc(NC(=O)c2ccsc2Br)s1	ZINC000698648053	976897175	/nfs/dbraw/zinc/89/71/75/976897175.db2.gz	ODKIJKVAVDDZJA-UHFFFAOYSA-N	-1	0	332.200	3.523	10	0		EHAERM
C[C@@H](c1ccc(C(=O)[O-])o1)N1Cc2ccc(Br)cc2C1	ZINC000707903887	977404437	/nfs/dbraw/zinc/40/44/37/977404437.db2.gz	CSBBFPMETACSFI-VIFPVBQESA-N	-1	0	336.185	3.817	10	0		EHAERM
CN(Cc1cc(C(=O)[O-])cs1)Cc1cscc1Br	ZINC000709891243	977472820	/nfs/dbraw/zinc/47/28/20/977472820.db2.gz	JGIGWMHLHQIJOY-UHFFFAOYSA-N	-1	0	346.271	3.902	10	0		EHAERM
O=C([O-])CC1CCN(Cc2cccc(Cl)c2Br)CC1	ZINC000719420559	978003912	/nfs/dbraw/zinc/00/39/12/978003912.db2.gz	CPPLHXZAJXFXRK-UHFFFAOYSA-N	-1	0	346.652	3.789	10	0		EHAERM
O=C([O-])c1occc1CNCc1cc(Cl)ccc1Br	ZINC000720118730	978025957	/nfs/dbraw/zinc/02/59/57/978025957.db2.gz	XHRMKVYUEMPJIH-UHFFFAOYSA-N	-1	0	344.592	3.684	10	0		EHAERM
O=C([O-])c1ccc(NCc2cc(Br)ccc2Cl)cn1	ZINC000722363906	978138800	/nfs/dbraw/zinc/13/88/00/978138800.db2.gz	XEZAWXAXXCNACO-UHFFFAOYSA-N	-1	0	341.592	3.808	10	0		EHAERM
CC[C@@H](C)CS(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1Cl	ZINC000050425770	214057099	/nfs/dbraw/zinc/05/70/99/214057099.db2.gz	UWSWDZXGRHWYQM-SSDOTTSWSA-N	-1	0	325.213	3.511	10	0		EHAERM
CC[C@@H](C(=O)[O-])[C@](C)(O)c1cc2cc(Br)ccc2o1	ZINC000052260549	214123826	/nfs/dbraw/zinc/12/38/26/214123826.db2.gz	VHCLMANNLZVNCO-HZMBPMFUSA-N	-1	0	327.174	3.514	10	0		EHAERM
C[C@H](Nc1ncnc2sc3c(c21)CC[C@@H](C(C)(C)C)C3)C(=O)[O-]	ZINC000058279504	214524494	/nfs/dbraw/zinc/52/44/94/214524494.db2.gz	BPISMUVMPWBOQD-VHSXEESVSA-N	-1	0	333.457	3.727	10	0		EHAERM
Nc1c([O-])c(Cl)c(Br)c(Cl)c1Br	ZINC000098180117	219086700	/nfs/dbraw/zinc/08/67/00/219086700.db2.gz	FVBRCESUKGOXRN-UHFFFAOYSA-N	-1	0	335.810	3.806	10	0		EHAERM
Nc1ccc(Oc2ccc(Br)cc2F)cc1C(=O)[O-]	ZINC000037933627	213174890	/nfs/dbraw/zinc/17/48/90/213174890.db2.gz	RDNPUVOAZHKELK-UHFFFAOYSA-N	-1	0	326.121	3.661	10	0		EHAERM
O=C([O-])c1ccc(F)cc1NC(=O)c1csc(Br)c1	ZINC000037452860	213148570	/nfs/dbraw/zinc/14/85/70/213148570.db2.gz	RLRJRTWIQBAJSS-UHFFFAOYSA-N	-1	0	344.161	3.600	10	0		EHAERM
CCc1c(C)nc(-c2ccncc2)nc1Nc1cccc(C(=O)[O-])c1	ZINC000070455719	215693905	/nfs/dbraw/zinc/69/39/05/215693905.db2.gz	CTANXGWNXMNUEZ-UHFFFAOYSA-N	-1	0	334.379	3.851	10	0		EHAERM
O=C([O-])c1c(O)c(Cc2c[nH]c3ccccc23)nc2ccc(F)cc21	ZINC000035087201	213008030	/nfs/dbraw/zinc/00/80/30/213008030.db2.gz	YYFHQTSEVCMUKC-UHFFFAOYSA-N	-1	0	336.322	3.850	10	0		EHAERM
CC(C)(C)OC(=O)NC[C@H](C(=O)[O-])c1ccc(Cl)c(Cl)c1	ZINC000022014714	212269778	/nfs/dbraw/zinc/26/97/78/212269778.db2.gz	AHSMQJDTARPKCV-VIFPVBQESA-N	-1	0	334.199	3.686	10	0		EHAERM
COCC(=O)Nc1scc(-c2ccc(C(C)C)cc2)c1C(=O)[O-]	ZINC000020334360	212120331	/nfs/dbraw/zinc/12/03/31/212120331.db2.gz	AAIZHZXSVCOTAJ-UHFFFAOYSA-N	-1	0	333.409	3.822	10	0		EHAERM
CCc1cc(C(=O)[O-])c(NC(=O)/C=C/c2cccc(OC)c2)s1	ZINC000020333353	212120845	/nfs/dbraw/zinc/12/08/45/212120845.db2.gz	SARINGMKSZWXPI-BQYQJAHWSA-N	-1	0	331.393	3.669	10	0		EHAERM
Cc1ccc(-c2csc(NC(=O)[C@H]3CCCO3)c2C(=O)[O-])cc1	ZINC000020334116	212120870	/nfs/dbraw/zinc/12/08/70/212120870.db2.gz	DIYXXXFLULADTL-CYBMUJFWSA-N	-1	0	331.393	3.539	10	0		EHAERM
O=C([O-])CCNc1ncnc2scc(-c3ccc(Cl)cc3)c21	ZINC000020313620	212118124	/nfs/dbraw/zinc/11/81/24/212118124.db2.gz	XYWZRICJEWHBIZ-UHFFFAOYSA-N	-1	0	333.800	3.898	10	0		EHAERM
C[C@@H]1CC[C@@]2(C)C(C(=O)[O-])=CCC[C@@H]2[C@@]1(C)CCC1=CCNC1=O	ZINC000085663172	217681717	/nfs/dbraw/zinc/68/17/17/217681717.db2.gz	SMVIBINEORXRIL-MPRPZVOOSA-N	-1	0	331.456	3.686	10	0	biogenic	EHAERM
O=C([O-])Cn1c(COc2ccc3ccccc3c2)nc2ccccc21	ZINC000057351699	527640290	/nfs/dbraw/zinc/64/02/90/527640290.db2.gz	QMJIINGGBFKRKT-UHFFFAOYSA-N	-1	0	332.359	3.853	10	0		EHAERM
CC(C)[C@@H]1CCC[C@](CNC(=O)OCc2ccccc2)(C(=O)[O-])C1	ZINC000725244336	563975739	/nfs/dbraw/zinc/97/57/39/563975739.db2.gz	HOUWTTRUZUGJAP-APWZRJJASA-N	-1	0	333.428	3.830	10	0		EHAERM
COc1ccc2c(c1)[C@@H](CC(=O)[O-])C[C@H](C)N2C(=O)OC(C)(C)C	ZINC000725253851	563982234	/nfs/dbraw/zinc/98/22/34/563982234.db2.gz	MNUJRSOIYMIYMH-NWDGAFQWSA-N	-1	0	335.400	3.787	10	0		EHAERM
O=C([O-])c1c(C2CCC2)[nH]sc1=NC(=O)OCc1ccccc1	ZINC000675076265	564113329	/nfs/dbraw/zinc/11/33/29/564113329.db2.gz	MXQSDDDVASHTFS-UHFFFAOYSA-N	-1	0	332.381	3.858	10	0		EHAERM
O=C([O-])[C@H](Nc1cc(F)c(Br)c(F)c1)c1ccccc1	ZINC000689664848	976259639	/nfs/dbraw/zinc/25/96/39/976259639.db2.gz	NQTWWRXEMULOQO-CYBMUJFWSA-N	-1	0	342.139	3.965	10	0		EHAERM
COC[C@@]1(C(=O)[O-])CCCCN1Cc1cc(Cl)sc1Cl	ZINC000692385672	976443028	/nfs/dbraw/zinc/44/30/28/976443028.db2.gz	CCNRJRYJNJWXMR-CYBMUJFWSA-N	-1	0	338.256	3.511	10	0		EHAERM
O=C([O-])c1ccc(F)c(NC(=O)c2ccsc2Br)c1	ZINC000704991426	977266357	/nfs/dbraw/zinc/26/63/57/977266357.db2.gz	NFSJYQNBSYXDIP-UHFFFAOYSA-N	-1	0	344.161	3.600	10	0		EHAERM
O=C([O-])c1ccc(COc2c(F)cccc2Br)cc1	ZINC000707058220	977374536	/nfs/dbraw/zinc/37/45/36/977374536.db2.gz	UGOKYDPGPNUUSG-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
O=C([O-])c1ccc(CN2CCc3c2cccc3Br)s1	ZINC000713307973	977633118	/nfs/dbraw/zinc/63/31/18/977633118.db2.gz	FDALHOMZIOUEJB-UHFFFAOYSA-N	-1	0	338.226	3.772	10	0		EHAERM
Cc1cc(C(=O)[O-])oc1C(=O)Nc1cc(Br)ccc1C	ZINC000717248579	977885346	/nfs/dbraw/zinc/88/53/46/977885346.db2.gz	YTBGYKDLKJFERI-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
Cc1cc(C(=O)[O-])oc1C(=O)Nc1ccc(Br)c(C)c1	ZINC000717248573	977885488	/nfs/dbraw/zinc/88/54/88/977885488.db2.gz	YQONMHYRBZEKPZ-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
C[C@@H]1C[C@H](COc2ccc(C(=O)[O-])cc2Br)C[C@H](C)O1	ZINC000724429758	978228637	/nfs/dbraw/zinc/22/86/37/978228637.db2.gz	KUOJBJHTHSXIMZ-URLYPYJESA-N	-1	0	343.217	3.730	10	0		EHAERM
CC(C)[C@@H](C)CC(=O)N[C@@H](CC(=O)[O-])c1ccc(Cl)c(F)c1	ZINC000236658622	1024062029	/nfs/dbraw/zinc/06/20/29/1024062029.db2.gz	MSSXTTXIULXWLP-HZMBPMFUSA-N	-1	0	329.799	3.793	10	0		EHAERM
CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2cc(F)ccc2Cl)c1	ZINC000103059495	1026044726	/nfs/dbraw/zinc/04/47/26/1026044726.db2.gz	ZWSSAXRLOVTZKX-JTQLQIEISA-N	-1	0	343.807	3.987	10	0		EHAERM
O=C([O-])Cn1nc(-c2ccccc2)c2cc(Br)ccc21	ZINC000049453304	214008003	/nfs/dbraw/zinc/00/80/03/214008003.db2.gz	NGJMJFBKYLJAEF-UHFFFAOYSA-N	-1	0	331.169	3.550	10	0		EHAERM
CC(C)(C)[C@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)[O-])CC1	ZINC000103541447	219313419	/nfs/dbraw/zinc/31/34/19/219313419.db2.gz	SYWRPZFKQKXPIE-BBWFWOEESA-N	-1	0	331.456	3.651	10	0	in-vitro	EHAERM
O=C([O-])c1nnn(-c2cc(F)cc(F)c2)c1-c1cccc(Cl)c1	ZINC000070456809	215694892	/nfs/dbraw/zinc/69/48/92/215694892.db2.gz	YDLNSZJUGGZOJO-UHFFFAOYSA-N	-1	0	335.697	3.564	10	0		EHAERM
O=c1c2sccc2[n-]c(=S)n1CCc1c[nH]c2ccccc12	ZINC000070460337	215696472	/nfs/dbraw/zinc/69/64/72/215696472.db2.gz	LFTWRCSEKMELNC-UHFFFAOYSA-N	-1	0	327.434	3.845	10	0		EHAERM
CCCCOc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)[O-])cc1	ZINC000035667713	213044146	/nfs/dbraw/zinc/04/41/46/213044146.db2.gz	CTQHDCNRUWJUDD-NBVRZTHBSA-N	-1	0	339.391	3.721	10	0		EHAERM
COCc1c([O-])ccc2c(C)c(-c3ccc(OC)cc3)c(=O)oc21	ZINC000072238414	216077509	/nfs/dbraw/zinc/07/75/09/216077509.db2.gz	UKTNHQYJLJHCBB-UHFFFAOYSA-N	-1	0	326.348	3.629	10	0		EHAERM
O=C([O-])CSc1nc2ccccc2c(=O)n1C1CCCCCCC1	ZINC000073659668	216407054	/nfs/dbraw/zinc/40/70/54/216407054.db2.gz	JIGLNVSWQRUJQY-UHFFFAOYSA-N	-1	0	346.452	3.859	10	0		EHAERM
O=C([O-])c1nc(Oc2ccc(Br)cc2)ccc1Cl	ZINC000019965750	212090217	/nfs/dbraw/zinc/09/02/17/212090217.db2.gz	PODKAACQBUFJTM-UHFFFAOYSA-N	-1	0	328.549	3.988	10	0		EHAERM
O=C([O-])c1cc(-c2ccccn2)nc2cc(Br)ccc21	ZINC000019484803	212032858	/nfs/dbraw/zinc/03/28/58/212032858.db2.gz	SFDAQICLJGNLBS-UHFFFAOYSA-N	-1	0	329.153	3.758	10	0		EHAERM
CC(C)Cn1nc(-c2ccccc2)c(-c2ccccc2)c(C(=O)[O-])c1=O	ZINC000011770325	211246408	/nfs/dbraw/zinc/24/64/08/211246408.db2.gz	ICJRRGUHWKUSDB-UHFFFAOYSA-N	-1	0	348.402	3.932	10	0		EHAERM
Cc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C(=O)[O-])c(Cl)c1	ZINC000409422240	563962053	/nfs/dbraw/zinc/96/20/53/563962053.db2.gz	CWCVWYQXUQWCRI-STQMWFEESA-N	-1	0	339.819	3.684	10	0		EHAERM
CCc1nc(C(Cl)(Cl)Cl)[n-]c(=S)c1Br	ZINC000685958679	564177067	/nfs/dbraw/zinc/17/70/67/564177067.db2.gz	DJHJZNCYNOIPFF-UHFFFAOYSA-N	-1	0	336.469	3.917	10	0		EHAERM
CC1(C)C(C)(C)C1(C(=O)[O-])C(=O)Nc1ccc(Br)cc1	ZINC000688596569	954631508	/nfs/dbraw/zinc/63/15/08/954631508.db2.gz	HQAGZGRDKYGGPW-UHFFFAOYSA-N	-1	0	340.217	3.525	10	0		EHAERM
O=C([O-])c1ccsc1NC(=O)c1ccsc1Br	ZINC000698647212	954845441	/nfs/dbraw/zinc/84/54/41/954845441.db2.gz	FSCUHPCKIZHMDW-UHFFFAOYSA-N	-1	0	332.200	3.523	10	0		EHAERM
O=C([O-])CN(Cc1coc(-c2ccc(F)cc2)n1)Cc1ccccc1	ZINC000692473754	976501436	/nfs/dbraw/zinc/50/14/36/976501436.db2.gz	IHFGGKXCZHFCOO-UHFFFAOYSA-N	-1	0	340.354	3.568	10	0		EHAERM
CCc1ccc(NC(=O)c2occc2Br)c(C(=O)[O-])c1	ZINC000696514834	976816907	/nfs/dbraw/zinc/81/69/07/976816907.db2.gz	UIEUCAWGXJIUMX-UHFFFAOYSA-N	-1	0	338.157	3.555	10	0		EHAERM
Cc1cc(COc2cc(C)ccc2Br)oc1C(=O)[O-]	ZINC000699657732	976927155	/nfs/dbraw/zinc/92/71/55/976927155.db2.gz	BTSMWGKOBRMDRR-UHFFFAOYSA-N	-1	0	325.158	3.936	10	0		EHAERM
CC1(C)CN(Cc2cc(C(=O)[O-])cs2)CC[N@@H+]1Cc1ccccc1	ZINC000711406552	977543571	/nfs/dbraw/zinc/54/35/71/977543571.db2.gz	IKTXBLKBBZWZTB-UHFFFAOYSA-N	-1	0	344.480	3.543	10	0		EHAERM
O=C([O-])c1cccc(CN2Cc3cccc(Br)c3C2)c1	ZINC000713195579	977631294	/nfs/dbraw/zinc/63/12/94/977631294.db2.gz	RALNCIOMZCQETC-UHFFFAOYSA-N	-1	0	332.197	3.663	10	0		EHAERM
O=C([O-])c1sccc1CN1CCc2ccc(Br)cc21	ZINC000713325136	977633149	/nfs/dbraw/zinc/63/31/49/977633149.db2.gz	RPICPJLCLZLAPM-UHFFFAOYSA-N	-1	0	338.226	3.772	10	0		EHAERM
CC(F)(F)CCC(=O)Nc1cc(Br)ccc1C(=O)[O-]	ZINC000714128907	977662269	/nfs/dbraw/zinc/66/22/69/977662269.db2.gz	ANGHDLKCQVHWGU-UHFFFAOYSA-N	-1	0	336.132	3.521	10	0		EHAERM
O=C([N-]S(=O)(=O)c1cccc2ccccc21)[C@H]1CC12CCCCC2	ZINC000408490155	1019648901	/nfs/dbraw/zinc/64/89/01/1019648901.db2.gz	ZCNINIOMIZPUOJ-MRXNPFEDSA-N	-1	0	343.448	3.615	10	0		EHAERM
C[C@H](C(=O)N1C[C@H](C(=O)[O-])C[C@@H](c2ccccc2)C1)c1cccs1	ZINC000245567125	1028855363	/nfs/dbraw/zinc/85/53/63/1028855363.db2.gz	RXRAUGYEPGZZKF-NUEKZKHPSA-N	-1	0	343.448	3.569	10	0		EHAERM
COc1ccc([C@@H]2C[C@@H](C)N(C(=O)c3cc(F)c([O-])c(F)c3)C2)cc1	ZINC000186823195	1035709141	/nfs/dbraw/zinc/70/91/41/1035709141.db2.gz	ZCQNEOJYQXVTNW-BXUZGUMPSA-N	-1	0	347.361	3.697	10	0		EHAERM
Cc1oc(-c2ccc(C(=O)[O-])cc2)nc1C[S@](=O)c1ccccc1	ZINC000049454352	214009408	/nfs/dbraw/zinc/00/94/08/214009408.db2.gz	YZUPBEAKXUPPDR-XMMPIXPASA-N	-1	0	341.388	3.656	10	0		EHAERM
O=C([O-])c1cc(Br)cnc1Nc1ccc(F)cc1F	ZINC000104173500	219355445	/nfs/dbraw/zinc/35/54/45/219355445.db2.gz	PTXDEVFRIZQDCE-UHFFFAOYSA-N	-1	0	329.100	3.564	10	0		EHAERM
C[C@@H]1CCC[C@H](Nc2ncc(Br)cc2C(=O)[O-])[C@@H]1C	ZINC000104184472	219357133	/nfs/dbraw/zinc/35/71/33/219357133.db2.gz	KDBUUMZFTDUYCA-LNLATYFQSA-N	-1	0	327.222	3.779	10	0		EHAERM
CCc1c(C)nc(-c2cccc(Cl)c2)nc1-n1cnc(C(=O)[O-])c1	ZINC000070452537	215693011	/nfs/dbraw/zinc/69/30/11/215693011.db2.gz	YWIKJNORNUYJST-UHFFFAOYSA-N	-1	0	342.786	3.552	10	0		EHAERM
CCCc1cc(N2CCC[C@@H](C(=O)[O-])C2)nc(-c2ccc(C)cc2)n1	ZINC000070452312	215693130	/nfs/dbraw/zinc/69/31/30/215693130.db2.gz	JHPSUEXVFBGNEK-MRXNPFEDSA-N	-1	0	339.439	3.706	10	0		EHAERM
CC(C)c1cc(N2CCC[C@H](C(=O)[O-])C2)nc(-c2ccccc2)n1	ZINC000070452299	215693172	/nfs/dbraw/zinc/69/31/72/215693172.db2.gz	LQOFZWYXPOUUHI-HNNXBMFYSA-N	-1	0	325.412	3.568	10	0		EHAERM
O=C([O-])c1cn(Cc2ccccc2Cl)c2cc(F)c(F)cc2c1=O	ZINC000070460724	215697042	/nfs/dbraw/zinc/69/70/42/215697042.db2.gz	OTKQNSMAERCRHA-UHFFFAOYSA-N	-1	0	349.720	3.680	10	0		EHAERM
Nc1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(F)c(Cl)c2)c1	ZINC000034940552	213002472	/nfs/dbraw/zinc/00/24/72/213002472.db2.gz	MJLNJPISCOJJND-UHFFFAOYSA-N	-1	0	335.187	3.516	10	0		EHAERM
COc1ccc2c(c1)c(CC(=O)[O-])cn2Cc1ccc(Cl)cc1	ZINC000034005591	212972577	/nfs/dbraw/zinc/97/25/77/212972577.db2.gz	XWVFVZXMCOPFOU-UHFFFAOYSA-N	-1	0	329.783	3.979	10	0		EHAERM
O=C([O-])CCSc1nc2ccccc2c(=O)n1C1CCCCCC1	ZINC000073659958	216408979	/nfs/dbraw/zinc/40/89/79/216408979.db2.gz	NXPGZAIMMHWQDC-UHFFFAOYSA-N	-1	0	346.452	3.859	10	0		EHAERM
Cc1ccc(-c2cc(OCC(=O)[O-])nc(N(C)c3ccccc3)n2)cc1	ZINC000073698257	216412660	/nfs/dbraw/zinc/41/26/60/216412660.db2.gz	GHMNAUSSOQWQQY-UHFFFAOYSA-N	-1	0	349.390	3.683	10	0		EHAERM
Cc1ccc(-c2csc3ncnc(NCCC(=O)[O-])c23)c(C)c1	ZINC000020315387	212119009	/nfs/dbraw/zinc/11/90/09/212119009.db2.gz	FAQDKETZWBSOTC-UHFFFAOYSA-N	-1	0	327.409	3.862	10	0		EHAERM
O=C([O-])c1cnc(Nc2ccc(Br)cc2)c(Cl)c1	ZINC000019845049	212075425	/nfs/dbraw/zinc/07/54/25/212075425.db2.gz	CSJFRXRWNLZGCT-UHFFFAOYSA-N	-1	0	327.565	3.939	10	0		EHAERM
O=C([O-])c1cccc(OCc2ccc(F)c(Br)c2)c1	ZINC000019803147	212070300	/nfs/dbraw/zinc/07/03/00/212070300.db2.gz	WGJBYHWSXRYHBH-UHFFFAOYSA-N	-1	0	325.133	3.865	10	0		EHAERM
COc1ccc(C(=O)[O-])cc1OCc1ccc(Br)s1	ZINC000019423336	212027099	/nfs/dbraw/zinc/02/70/99/212027099.db2.gz	JKHAYTIPSONAQM-UHFFFAOYSA-N	-1	0	343.198	3.796	10	0		EHAERM
CC(C)(C)OC(=O)N[C@@H](CCc1ccc(Cl)cc1Cl)C(=O)[O-]	ZINC000095749213	218447694	/nfs/dbraw/zinc/44/76/94/218447694.db2.gz	VUYVPAFEEKNNLK-LBPRGKRZSA-N	-1	0	348.226	3.904	10	0		EHAERM
O=C([O-])c1nc(-c2ccccc2Cl)n(-c2ccc(Cl)cc2)n1	ZINC000045921404	258003479	/nfs/dbraw/zinc/00/34/79/258003479.db2.gz	ZJOBEIRSCOBADZ-UHFFFAOYSA-N	-1	0	334.162	3.939	10	0		EHAERM
CCCC1CCC(CNC(=O)OCc2ccccc2)(C(=O)[O-])CC1	ZINC000725245725	563976097	/nfs/dbraw/zinc/97/60/97/563976097.db2.gz	XRKCZGWDGLSACH-UHFFFAOYSA-N	-1	0	333.428	3.974	10	0		EHAERM
CC(C)(C(=O)[O-])[C@H](NC(=O)OCc1ccccc1)c1ccc(F)cc1	ZINC000536959731	564091789	/nfs/dbraw/zinc/09/17/89/564091789.db2.gz	SSXICQOJNWCBGV-MRXNPFEDSA-N	-1	0	345.370	3.904	10	0		EHAERM
C[C@H]1C[C@@H](c2ccc(C(=O)[O-])cc2)CN1C(=O)OCc1ccccc1	ZINC000536959750	564091809	/nfs/dbraw/zinc/09/18/09/564091809.db2.gz	SSIXLCPGBPIJEO-KBXCAEBGSA-N	-1	0	339.391	3.899	10	0		EHAERM
CCCCN(Cc1ccccc1)c1ncc(NC(C)=O)cc1C(=O)[O-]	ZINC000064978741	564098872	/nfs/dbraw/zinc/09/88/72/564098872.db2.gz	NTEDOWXYCCDOFM-UHFFFAOYSA-N	-1	0	341.411	3.545	10	0		EHAERM
Cc1cc(NCc2ccc(C(=O)[O-])s2)cnc1Br	ZINC000706240519	969015055	/nfs/dbraw/zinc/01/50/55/969015055.db2.gz	WFZGDGDQFPYWOK-UHFFFAOYSA-N	-1	0	327.203	3.524	10	0		EHAERM
O=C([O-])CN(Cc1ccccc1)C(=O)c1cc2sccc2s1	ZINC000692459041	976489971	/nfs/dbraw/zinc/48/99/71/976489971.db2.gz	WQOSZQVJTXGIBK-UHFFFAOYSA-N	-1	0	331.418	3.690	10	0		EHAERM
O=C([O-])c1cc(Br)cc(Oc2nc(C3CC3)ns2)c1	ZINC000700729673	976966711	/nfs/dbraw/zinc/96/67/11/976966711.db2.gz	GCCZXVDJCWRXMW-UHFFFAOYSA-N	-1	0	341.186	3.669	10	0		EHAERM
CC1(C)CC(C(=O)Nc2cc(Br)ccc2C(=O)[O-])C1	ZINC000701490168	977017403	/nfs/dbraw/zinc/01/74/03/977017403.db2.gz	IYVCAJIPVSZRDO-UHFFFAOYSA-N	-1	0	326.190	3.522	10	0		EHAERM
O=C([O-])[C@H](CNc1nc2cc(Br)ccc2o1)CC1CC1	ZINC000705845154	977296868	/nfs/dbraw/zinc/29/68/68/977296868.db2.gz	MMQOLGZFWCFDCF-VIFPVBQESA-N	-1	0	339.189	3.503	10	0		EHAERM
Cc1cc(C(=O)Nc2cc(C)cc(Br)c2)oc1C(=O)[O-]	ZINC000707509183	977397382	/nfs/dbraw/zinc/39/73/82/977397382.db2.gz	QSMPHXHYYMXYKZ-UHFFFAOYSA-N	-1	0	338.157	3.609	10	0		EHAERM
Cc1cc(CN2Cc3ccc(Br)cc3C2)oc1C(=O)[O-]	ZINC000707903932	977404372	/nfs/dbraw/zinc/40/43/72/977404372.db2.gz	DEXUBSRPGNNGLQ-UHFFFAOYSA-N	-1	0	336.185	3.565	10	0		EHAERM
O=C([O-])[C@@H]1CC[C@H]1C(=O)N1CCCCC[C@H]1/C=C/c1cccs1	ZINC000261963163	1029541068	/nfs/dbraw/zinc/54/10/68/1029541068.db2.gz	AUPRNQINXMYEMZ-NZXCHNHRSA-N	-1	0	333.453	3.643	10	0		EHAERM
COc1ccc([C@H]2C[C@@H](C)N(C(=O)c3cc(F)c([O-])c(F)c3)C2)cc1	ZINC000186823154	1035710136	/nfs/dbraw/zinc/71/01/36/1035710136.db2.gz	ZCQNEOJYQXVTNW-RISCZKNCSA-N	-1	0	347.361	3.697	10	0		EHAERM
Cc1[nH]c2ccc(C(=O)N3[C@@H]4CCCC[C@@H]4C[C@H]3C(=O)[O-])cc2c1C	ZINC000326690714	1128430772	/nfs/dbraw/zinc/43/07/72/1128430772.db2.gz	QWGXZPXVOCWLFD-XWIAVFTESA-N	-1	0	340.423	3.643	10	0		EHAERM
C[C@@H]1CCC[C@@H](Nc2ncc(Br)cc2C(=O)[O-])[C@@H]1C	ZINC000104184475	219356353	/nfs/dbraw/zinc/35/63/53/219356353.db2.gz	KDBUUMZFTDUYCA-KBVBSXBZSA-N	-1	0	327.222	3.779	10	0		EHAERM
C[C@H]1[C@H](Nc2ncc(Br)cc2C(=O)[O-])CCC[C@@H]1C	ZINC000104184477	219356449	/nfs/dbraw/zinc/35/64/49/219356449.db2.gz	KDBUUMZFTDUYCA-YGOYTEALSA-N	-1	0	327.222	3.779	10	0		EHAERM
Cc1c(N)cccc1[N-]S(=O)(=O)c1cc(Cl)sc1Cl	ZINC000036961623	213127610	/nfs/dbraw/zinc/12/76/10/213127610.db2.gz	HROYXTMOBYZTES-UHFFFAOYSA-N	-1	0	337.253	3.746	10	0		EHAERM
O=C([O-])c1nnn(Cc2ccc(Cl)cc2)c1-c1cc(F)cc(F)c1	ZINC000070457181	215695721	/nfs/dbraw/zinc/69/57/21/215695721.db2.gz	WLHQKAACUDTHLF-UHFFFAOYSA-N	-1	0	349.724	3.623	10	0		EHAERM
Nc1cc(F)ccc1[N-]S(=O)(=O)c1cc(Cl)sc1Cl	ZINC000037376257	213143247	/nfs/dbraw/zinc/14/32/47/213143247.db2.gz	IBKJOEBWSRIVOM-UHFFFAOYSA-N	-1	0	341.216	3.577	10	0		EHAERM
Cc1ccc(-c2cc(OCC(=O)[O-])nc(-c3ccc(C)cc3)n2)cc1	ZINC000073696463	216413178	/nfs/dbraw/zinc/41/31/78/216413178.db2.gz	CFNWTVOJHFKXFB-UHFFFAOYSA-N	-1	0	334.375	3.891	10	0		EHAERM
CCCOc1ccc(/C=C/C(=O)[O-])c(OCc2csc(C)n2)c1	ZINC000020284921	212116811	/nfs/dbraw/zinc/11/68/11/212116811.db2.gz	AZJHLXQOVYZMFS-FNORWQNLSA-N	-1	0	333.409	3.917	10	0		EHAERM
Cc1sc(NC(=O)[C@H]2CCCO2)c(C(=O)[O-])c1-c1ccc(C)cc1	ZINC000020334533	212120374	/nfs/dbraw/zinc/12/03/74/212120374.db2.gz	FVQJXYXIEXLABB-CYBMUJFWSA-N	-1	0	345.420	3.848	10	0		EHAERM
O=C([O-])c1c(NC(=O)c2c(F)cccc2Cl)sc2c1CCC2	ZINC000020334695	212120160	/nfs/dbraw/zinc/12/01/60/212120160.db2.gz	VIOZHSIPGQSGCP-UHFFFAOYSA-N	-1	0	339.775	3.980	10	0		EHAERM
Cc1sc2ncnc(N(C)CCC(=O)[O-])c2c1-c1ccc(F)cc1	ZINC000020317879	212119013	/nfs/dbraw/zinc/11/90/13/212119013.db2.gz	UHQLKSIVSHOCST-UHFFFAOYSA-N	-1	0	345.399	3.717	10	0		EHAERM
Cc1sc2ncnc(N(C)CCC(=O)[O-])c2c1-c1ccc(C)cc1	ZINC000020317946	212118451	/nfs/dbraw/zinc/11/84/51/212118451.db2.gz	AGMZYJYTQSBHGJ-UHFFFAOYSA-N	-1	0	341.436	3.886	10	0		EHAERM
CC/C=C\C/C=C\C[C@@H](O)/C=C/C=C/C=C\[C@@H](O)CCCC(=O)[O-]	ZINC000012496517	211393574	/nfs/dbraw/zinc/39/35/74/211393574.db2.gz	BISQPGCQOHLHQK-HDNPQISLSA-N	-1	0	334.456	3.934	10	0	endogenous,in-man	EHAERM
O=C([O-])c1nc(-c2ccccc2Cl)n(-c2cccc(Cl)c2)n1	ZINC000045921400	258003713	/nfs/dbraw/zinc/00/37/13/258003713.db2.gz	RJNHNWOIGDSGGV-UHFFFAOYSA-N	-1	0	334.162	3.939	10	0		EHAERM
CC(C)[C@H]1CCC[C@](CNC(=O)OCc2ccccc2)(C(=O)[O-])C1	ZINC000725244337	563975764	/nfs/dbraw/zinc/97/57/64/563975764.db2.gz	HOUWTTRUZUGJAP-LPHOPBHVSA-N	-1	0	333.428	3.830	10	0		EHAERM
O=C([O-])c1ccc(Br)c(NC(=O)[C@@]23C[C@@H]2CCCC3)c1	ZINC000693240606	954730101	/nfs/dbraw/zinc/73/01/01/954730101.db2.gz	FCQQLDIPENLGIS-BONVTDFDSA-N	-1	0	338.201	3.666	10	0		EHAERM
Cc1c(Cl)cccc1C(=O)N(CCC(=O)[O-])Cc1ccccc1	ZINC000692456971	976489633	/nfs/dbraw/zinc/48/96/33/976489633.db2.gz	XUSFFSNJVQENCM-UHFFFAOYSA-N	-1	0	331.799	3.766	10	0		EHAERM
O=C([O-])c1ccc(OCc2ccc(Cl)cn2)c(Br)c1	ZINC000703865043	977207359	/nfs/dbraw/zinc/20/73/59/977207359.db2.gz	ZNUWZWOJNAUKSF-UHFFFAOYSA-N	-1	0	342.576	3.775	10	0		EHAERM
CC(C)C[C@H](C)C(=O)Nc1ccc(Br)cc1C(=O)[O-]	ZINC000704611709	977240593	/nfs/dbraw/zinc/24/05/93/977240593.db2.gz	PZABICZJFOOCHE-VIFPVBQESA-N	-1	0	328.206	3.768	10	0		EHAERM
CC(C)C[C@H](CNc1nc2cc(Br)ccc2o1)C(=O)[O-]	ZINC000705853753	977297684	/nfs/dbraw/zinc/29/76/84/977297684.db2.gz	LBULXRLNSUUBJR-SECBINFHSA-N	-1	0	341.205	3.749	10	0		EHAERM
O=C([O-])c1cc2cc(NC(=O)/C=C\c3cncc(F)c3)ccc2s1	ZINC000588592428	1032097382	/nfs/dbraw/zinc/09/73/82/1032097382.db2.gz	NZJBBUOJGWKJRR-RJRFIUFISA-N	-1	0	342.351	3.786	10	0		EHAERM
Cc1nc([C@@H]2CCCN(C(=O)c3c([O-])cccc3F)C2)sc1C	ZINC000408407186	1039374905	/nfs/dbraw/zinc/37/49/05/1039374905.db2.gz	KISZIJKSJLNWQU-GFCCVEGCSA-N	-1	0	334.416	3.624	10	0		EHAERM
Nc1c(Nc2ccc(C(=O)[O-])cc2)ncnc1Sc1ccccc1	ZINC000040783250	213387147	/nfs/dbraw/zinc/38/71/47/213387147.db2.gz	CHBCKJUMRGTRNC-UHFFFAOYSA-N	-1	0	338.392	3.652	10	0		EHAERM
O=S(=O)([N-]c1ccc(Cl)c(Cl)c1)c1ccnc(Cl)c1	ZINC000038008535	213188719	/nfs/dbraw/zinc/18/87/19/213188719.db2.gz	FKYCIIHJRBNRRY-UHFFFAOYSA-N	-1	0	337.615	3.843	10	0		EHAERM
CCCOc1ccc(-c2nc3cc(C(=O)[O-])ccc3[nH]2)cc1OC	ZINC000019943869	212088696	/nfs/dbraw/zinc/08/86/96/212088696.db2.gz	DSBCEVMQTXTRAA-UHFFFAOYSA-N	-1	0	326.352	3.726	10	0		EHAERM
O=C([O-])c1cnc(Nc2ccccc2Br)c(Cl)c1	ZINC000019845044	212075086	/nfs/dbraw/zinc/07/50/86/212075086.db2.gz	SHKVCQNORNCCTA-UHFFFAOYSA-N	-1	0	327.565	3.939	10	0		EHAERM
Cc1nc(NCc2cccc(Br)c2)sc1C(=O)[O-]	ZINC000008018871	210884093	/nfs/dbraw/zinc/88/40/93/210884093.db2.gz	NHVPULJRJPRNFJ-UHFFFAOYSA-N	-1	0	327.203	3.524	10	0		EHAERM
CC(C)(C)OC(=O)N[C@@H](CCc1ccccc1C(F)(F)F)C(=O)[O-]	ZINC000095749156	218447724	/nfs/dbraw/zinc/44/77/24/218447724.db2.gz	SWWMIAKBHAXMBF-LBPRGKRZSA-N	-1	0	347.333	3.616	10	0		EHAERM
CC(C)(C)OC(=O)N1CCC[C@@H]([C@H](CC(=O)[O-])c2ccccc2)C1	ZINC000072208557	518805625	/nfs/dbraw/zinc/80/56/25/518805625.db2.gz	GFSZVZUFMSYLQR-HZPDHXFCSA-N	-1	0	333.428	3.892	10	0		EHAERM
CC[C@H]1CCC[C@](CNC(=O)OCc2ccccc2)(C(=O)[O-])CC1	ZINC000725245883	563976078	/nfs/dbraw/zinc/97/60/78/563976078.db2.gz	YUNNBBOFSKYWMW-KXBFYZLASA-N	-1	0	333.428	3.974	10	0		EHAERM
C[C@@H]1C[C@@H](NC(=O)OCc2ccccc2)c2c1c(F)ccc2C(=O)[O-]	ZINC000536959925	564091791	/nfs/dbraw/zinc/09/17/91/564091791.db2.gz	LWSAVCBZWQWLEV-IAQYHMDHSA-N	-1	0	343.354	3.999	10	0		EHAERM
CC1(C)CC(C(=O)Nc2cc(C(=O)[O-])ccc2Br)C1	ZINC000701492189	954883220	/nfs/dbraw/zinc/88/32/20/954883220.db2.gz	KAGLIUFOCNVYCW-UHFFFAOYSA-N	-1	0	326.190	3.522	10	0		EHAERM
COc1cc(Br)ccc1NCc1csc(C(=O)[O-])c1	ZINC000712294458	977578844	/nfs/dbraw/zinc/57/88/44/977578844.db2.gz	VLBACSHSNPFYKD-UHFFFAOYSA-N	-1	0	342.214	3.830	10	0		EHAERM
Cc1cc(CN2Cc3cccc(Br)c3C2)oc1C(=O)[O-]	ZINC000713191252	977631178	/nfs/dbraw/zinc/63/11/78/977631178.db2.gz	BROVDABTEXQTKL-UHFFFAOYSA-N	-1	0	336.185	3.565	10	0		EHAERM
CC(F)(F)CCC(=O)Nc1ccc(Br)c(C(=O)[O-])c1	ZINC000714129219	977663258	/nfs/dbraw/zinc/66/32/58/977663258.db2.gz	KAZWDBNLDRWJBP-UHFFFAOYSA-N	-1	0	336.132	3.521	10	0		EHAERM
CC1(C)CCC[C@@H](COc2ccc(C(=O)[O-])cc2Br)O1	ZINC000714320532	977667593	/nfs/dbraw/zinc/66/75/93/977667593.db2.gz	KVRWCZVXDUIXAZ-NSHDSACASA-N	-1	0	343.217	3.874	10	0		EHAERM
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(Br)c(C(=O)[O-])c1	ZINC000714401682	977671419	/nfs/dbraw/zinc/67/14/19/977671419.db2.gz	KQGASPQURPZBIZ-KOLCDFICSA-N	-1	0	340.217	3.912	10	0		EHAERM
CN(Cc1ccc(C(=O)[O-])cc1F)c1ccc(Br)cc1	ZINC000723905668	978220744	/nfs/dbraw/zinc/22/07/44/978220744.db2.gz	AIBWRNMWXFVFIN-UHFFFAOYSA-N	-1	0	338.176	3.923	10	0		EHAERM
COc1ccc(-c2cc(C(=O)[O-])c3cccc(OC)c3n2)cc1OC	ZINC000004227725	210148969	/nfs/dbraw/zinc/14/89/69/210148969.db2.gz	NMSKYWKAOZLJNI-UHFFFAOYSA-N	-1	0	339.347	3.626	10	0		EHAERM
CCCCCOc1c(Br)cc(CC(=O)[O-])cc1OC	ZINC000004227530	210148485	/nfs/dbraw/zinc/14/84/85/210148485.db2.gz	XQSXLEKVGIUTHQ-UHFFFAOYSA-N	-1	0	331.206	3.654	10	0		EHAERM
CC(=O)Nc1cc(C(=O)[O-])nc2c(Cl)ccc(C(F)(F)F)c12	ZINC000040176289	213279986	/nfs/dbraw/zinc/27/99/86/213279986.db2.gz	ADCROEKUCMLODP-UHFFFAOYSA-N	-1	0	332.665	3.564	10	0		EHAERM
O=C([O-])c1sc2ccccc2c1Cn1cc(Br)cn1	ZINC000038054184	213198532	/nfs/dbraw/zinc/19/85/32/213198532.db2.gz	PLIHTNBNLKBWTQ-UHFFFAOYSA-N	-1	0	337.198	3.607	10	0		EHAERM
O=C([O-])[C@@H](NCc1cccs1)c1ccc(Br)cc1F	ZINC000037966666	213176593	/nfs/dbraw/zinc/17/65/93/213176593.db2.gz	PLJVUOHEUCZUTB-LBPRGKRZSA-N	-1	0	344.205	3.565	10	0		EHAERM
CC(C)c1nc(-c2ccccc2)cc(N2CCCC[C@@H]2C(=O)[O-])n1	ZINC000070452255	215692271	/nfs/dbraw/zinc/69/22/71/215692271.db2.gz	AATXLFWJEXHUCK-MRXNPFEDSA-N	-1	0	325.412	3.711	10	0		EHAERM
CCOc1cc(N(CC)CC)ccc1C(=O)c1ccccc1C(=O)[O-]	ZINC000034577264	212979608	/nfs/dbraw/zinc/97/96/08/212979608.db2.gz	CPEQFJYBWAAQLE-UHFFFAOYSA-N	-1	0	341.407	3.861	10	0		EHAERM
Cc1cccc(OCC(=O)Nc2sc3c(c2C(=O)[O-])CCC3)c1C	ZINC000020334711	212120735	/nfs/dbraw/zinc/12/07/35/212120735.db2.gz	FQDUTAPZSBUZRF-UHFFFAOYSA-N	-1	0	345.420	3.569	10	0		EHAERM
CCc1ccc(OCC(=O)Nc2sc(C)c(C)c2C(=O)[O-])cc1	ZINC000020332810	212119400	/nfs/dbraw/zinc/11/94/00/212119400.db2.gz	ORHRVUXJYFKSLM-UHFFFAOYSA-N	-1	0	333.409	3.643	10	0		EHAERM
O=C([O-])c1cc(-c2ccco2)n(-c2ccc(Br)cc2)n1	ZINC000019803713	212071273	/nfs/dbraw/zinc/07/12/73/212071273.db2.gz	TZMPQJXOHHBALF-UHFFFAOYSA-N	-1	0	333.141	3.593	10	0		EHAERM
Cc1sc2nc(Cc3ccccc3)nc(N[C@H](C)C(=O)[O-])c2c1C	ZINC000008548680	210963408	/nfs/dbraw/zinc/96/34/08/210963408.db2.gz	PWMOGMHQTKNBRE-LLVKDONJSA-N	-1	0	341.436	3.784	10	0		EHAERM
CCN(c1cccc(C)c1)c1nc(OCC(=O)[O-])cc(C(C)C)n1	ZINC000073698408	521493942	/nfs/dbraw/zinc/49/39/42/521493942.db2.gz	XJUHJEZBLDVEDI-UHFFFAOYSA-N	-1	0	329.400	3.530	10	0		EHAERM
CC1(C)CCC[C@@](CNC(=O)OCc2ccccc2)(C(=O)[O-])CC1	ZINC000725244856	563975875	/nfs/dbraw/zinc/97/58/75/563975875.db2.gz	NGXCAFSZCDDVLP-LJQANCHMSA-N	-1	0	333.428	3.974	10	0		EHAERM
COc1cccc2c1N(C(=O)OC(C)(C)C)[C@H](C)C[C@@H]2CC(=O)[O-]	ZINC000725253646	563982191	/nfs/dbraw/zinc/98/21/91/563982191.db2.gz	CHHWYIJJOZAFBE-VXGBXAGGSA-N	-1	0	335.400	3.787	10	0		EHAERM
O=[S@]([O-])c1ccc(Oc2ccc(F)cc2)c(Br)c1	ZINC000675061522	564112327	/nfs/dbraw/zinc/11/23/27/564112327.db2.gz	ICYAOMLYFKIJCF-UHFFFAOYSA-N	-1	0	331.162	3.961	10	0		EHAERM
CCc1cc(C(F)(F)Br)nc(C(F)F)c1C(=O)[O-]	ZINC000675082391	564114134	/nfs/dbraw/zinc/11/41/34/564114134.db2.gz	ZOXOKUVYRXCIGQ-UHFFFAOYSA-N	-1	0	330.075	3.724	10	0		EHAERM