smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(O)c2c(c1)oc1cc([O-])cc(C(=O)[O-])c1c2=O	ZINC000013335390	301369689	/nfs/dbraw/zinc/36/96/89/301369689.db2.gz	XSPSQSXYKJASKD-UHFFFAOYSA-N	-2	1	286.239	2.364	10	5		CEBEML
O=C([O-])c1ccc(NC(=O)c2ccc([N+](=O)[O-])[n-]2)c(F)c1	ZINC000063008907	526377293	/nfs/dbraw/zinc/37/72/93/526377293.db2.gz	YGTQZENGNMOZPY-UHFFFAOYSA-N	-2	1	293.210	2.013	10	5		CEBEML
O=C([O-])Cc1cccc2c(=O)c3cccc([O-])c3oc12	ZINC000028769800	361676595	/nfs/dbraw/zinc/67/65/95/361676595.db2.gz	FMTHUOUQOSGHKB-UHFFFAOYSA-N	-2	1	270.240	2.279	10	5		CEBEML
O=C([O-])c1cnc2c(ccc3c([O-])c([N+](=O)[O-])cnc32)c1	ZINC000033963271	304279326	/nfs/dbraw/zinc/27/93/26/304279326.db2.gz	WNSJJSZSXGEBFT-UHFFFAOYSA-N	-2	1	285.215	2.095	10	5		CEBEML
O=C([O-])Cc1cccc2c(=O)c3ccc([O-])cc3oc12	ZINC000027882814	361661705	/nfs/dbraw/zinc/66/17/05/361661705.db2.gz	NJEPKIHMLUUPIH-UHFFFAOYSA-N	-2	1	270.240	2.279	10	5		CEBEML
Cc1cc([O-])c2c(c1)oc(=O)c1cccc(=O)c-1c2[O-]	ZINC000225447042	394468128	/nfs/dbraw/zinc/46/81/28/394468128.db2.gz	GXBVJTTXZBEHQB-UHFFFAOYSA-N	-2	1	270.240	2.026	10	5		CEBEML
Cc1cc(C(=O)[O-])c(NC(=O)c2ccc([N+](=O)[O-])[n-]2)s1	ZINC000110775039	186323137	/nfs/dbraw/zinc/32/31/37/186323137.db2.gz	DVYHVMDCZHSINL-UHFFFAOYSA-N	-2	1	295.276	2.243	10	5		CEBEML
Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])[n-]2)c1C(=O)[O-]	ZINC000071164058	176046918	/nfs/dbraw/zinc/04/69/18/176046918.db2.gz	XTWHEQVVDLQYQP-UHFFFAOYSA-N	-2	1	289.247	2.182	10	5		CEBEML
COc1cc([O-])c2c([O-])c3c(=O)cc(OC)cc-3oc2c1	ZINC000014764540	361460482	/nfs/dbraw/zinc/46/04/82/361460482.db2.gz	AEUSBLWMURRGLG-UHFFFAOYSA-N	-2	1	288.255	2.375	10	5		CEBEML