smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@H]2c2cccc(F)c2)cc1	ZINC000004928682	559208426	/nfs/dbraw/zinc/20/84/26/559208426.db2.gz	UEUISRCESMBVCV-JOCHJYFZSA-N	-1	2	413.408	4.664	50	0		HJAALM
Cc1ccc(-c2n[nH]c3c2[C@@H](c2ccccc2)N(c2ccc(C(=O)[O-])cc2)C3=O)cc1	ZINC000004928689	559208573	/nfs/dbraw/zinc/20/85/73/559208573.db2.gz	UADHLQCUBKDLGB-HSZRJFAPSA-N	-1	2	409.445	4.833	50	0		HJAALM
Cc1ccc(-c2n[nH]c3c2[C@H](c2ccccc2)N(c2ccc(C(=O)[O-])cc2)C3=O)cc1	ZINC000004928693	559208523	/nfs/dbraw/zinc/20/85/23/559208523.db2.gz	UADHLQCUBKDLGB-QHCPKHFHSA-N	-1	2	409.445	4.833	50	0		HJAALM
Cc1cc(-c2ccccc2)nc(Nc2nc(-c3ccccc3)c(CC(=O)[O-])s2)n1	ZINC000020807908	558416274	/nfs/dbraw/zinc/41/62/74/558416274.db2.gz	SRLAIRGYWNOODE-UHFFFAOYSA-N	-1	2	402.479	4.946	50	0		HJAALM
CCCc1cc2c(cc1O)oc(CCC(=O)[O-])c(-c1nc3ccccc3s1)c2=O	ZINC000011867624	569399079	/nfs/dbraw/zinc/39/90/79/569399079.db2.gz	SDAXEZNYJPOQCF-UHFFFAOYSA-N	-1	2	409.463	4.745	50	0		HJAALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@H]2c2ccc(F)cc2)cc1	ZINC000004928671	559208450	/nfs/dbraw/zinc/20/84/50/559208450.db2.gz	JLYMUDGOIIEHMR-JOCHJYFZSA-N	-1	2	413.408	4.664	50	0		HJAALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@H]2c2ccccc2F)cc1	ZINC000004928675	559208372	/nfs/dbraw/zinc/20/83/72/559208372.db2.gz	HVXOGVNAMZQMGT-JOCHJYFZSA-N	-1	2	413.408	4.664	50	0		HJAALM
Cc1ccc([C@@H]2c3c([nH]nc3-c3ccccc3)C(=O)N2c2ccc(C(=O)[O-])cc2)cc1	ZINC000004928666	559208381	/nfs/dbraw/zinc/20/83/81/559208381.db2.gz	WHEACYVMMJXYPE-HSZRJFAPSA-N	-1	2	409.445	4.833	50	0		HJAALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@@H]2c2ccc(F)cc2)cc1	ZINC000004928672	559208410	/nfs/dbraw/zinc/20/84/10/559208410.db2.gz	JLYMUDGOIIEHMR-QFIPXVFZSA-N	-1	2	413.408	4.664	50	0		HJAALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@@H]2c2cccc(F)c2)cc1	ZINC000004928686	559208357	/nfs/dbraw/zinc/20/83/57/559208357.db2.gz	UEUISRCESMBVCV-QFIPXVFZSA-N	-1	2	413.408	4.664	50	0		HJAALM
Cc1ccc([C@H]2c3c([nH]nc3-c3ccccc3)C(=O)N2c2ccc(C(=O)[O-])cc2)cc1	ZINC000004928667	559208417	/nfs/dbraw/zinc/20/84/17/559208417.db2.gz	WHEACYVMMJXYPE-QHCPKHFHSA-N	-1	2	409.445	4.833	50	0		HJAALM
CCc1cc2c(cc1O)oc(CCCC(=O)[O-])c(-c1nc3ccccc3s1)c2=O	ZINC000000634092	568456589	/nfs/dbraw/zinc/45/65/89/568456589.db2.gz	CLJCGRFBTJNFJE-UHFFFAOYSA-N	-1	2	409.463	4.745	50	0		HJAALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@@H]2c2ccccc2F)cc1	ZINC000004928679	559208458	/nfs/dbraw/zinc/20/84/58/559208458.db2.gz	HVXOGVNAMZQMGT-QFIPXVFZSA-N	-1	2	413.408	4.664	50	0		HJAALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@@H]2c2cccs2)cc1	ZINC000000626683	557022952	/nfs/dbraw/zinc/02/29/52/557022952.db2.gz	MROCJNRJYNHDNK-FQEVSTJZSA-N	-1	2	401.447	4.586	50	0		HJAALM
CCCN(CCC)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1C(=O)[O-]	ZINC000032962091	521650870	/nfs/dbraw/zinc/65/08/70/521650870.db2.gz	VVMOQLVJVRSHFE-UHFFFAOYSA-N	-1	2	416.952	4.527	50	0		HJAALM
COc1ccc(C[N@@H+](Cc2nc(=O)c3cc(-c4ccccc4)sc3[nH]2)C2CC2)cc1	ZINC000057672109	568857958	/nfs/dbraw/zinc/85/79/58/568857958.db2.gz	SIBSZHACRJINSE-UHFFFAOYSA-N	-1	2	417.534	4.825	50	0		HJAALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@H]2c2cccs2)cc1	ZINC000000626686	557022854	/nfs/dbraw/zinc/02/28/54/557022854.db2.gz	MROCJNRJYNHDNK-HXUWFJFHSA-N	-1	2	401.447	4.586	50	0		HJAALM
CCCCN(CC)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1C(=O)[O-]	ZINC000032962128	520485014	/nfs/dbraw/zinc/48/50/14/520485014.db2.gz	HOIJJDIWSBYHCO-UHFFFAOYSA-N	-1	2	416.952	4.527	50	0		HJAALM
O=C([O-])c1cc(NS(=O)(=O)c2cc(Cl)sc2Cl)cc(C(F)(F)F)c1	ZINC000057769699	568860307	/nfs/dbraw/zinc/86/03/07/568860307.db2.gz	JLJUAUCFCXITJL-UHFFFAOYSA-N	-1	2	420.217	4.573	50	0		HJAALM