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]2c2ccccc2[N+](=O)[O-])cc1	ZINC000002751114	569420268	/nfs/dbraw/zinc/42/02/68/569420268.db2.gz	PRKQJZMYYXYJBS-QFIPXVFZSA-N	-1	2	440.415	4.433	50	5		IIBALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@@H]2c2ccc([N+](=O)[O-])cc2)cc1	ZINC000002745891	569420124	/nfs/dbraw/zinc/42/01/24/569420124.db2.gz	FAPWESYGTXHTQV-QFIPXVFZSA-N	-1	2	440.415	4.433	50	5		IIBALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@H]2c2cccc([N+](=O)[O-])c2)cc1	ZINC000002745865	569420069	/nfs/dbraw/zinc/42/00/69/569420069.db2.gz	RHTFHZQKEPKSCE-JOCHJYFZSA-N	-1	2	440.415	4.433	50	5		IIBALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@@H]2c2cccc([N+](=O)[O-])c2)cc1	ZINC000002745864	569420155	/nfs/dbraw/zinc/42/01/55/569420155.db2.gz	RHTFHZQKEPKSCE-QFIPXVFZSA-N	-1	2	440.415	4.433	50	5		IIBALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@H]2c2ccccc2[N+](=O)[O-])cc1	ZINC000002751115	569420304	/nfs/dbraw/zinc/42/03/04/569420304.db2.gz	PRKQJZMYYXYJBS-JOCHJYFZSA-N	-1	2	440.415	4.433	50	5		IIBALM
O=C([O-])c1ccc(N2C(=O)c3[nH]nc(-c4ccccc4)c3[C@H]2c2ccc([N+](=O)[O-])cc2)cc1	ZINC000002745892	560188483	/nfs/dbraw/zinc/18/84/83/560188483.db2.gz	FAPWESYGTXHTQV-JOCHJYFZSA-N	-1	2	440.415	4.433	50	5	in-vitro	IIBALM