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-])c1[nH]c2c(cccc2[N+](=O)[O-])c1CCNC(=O)c1ccccc1C(=O)[O-]	ZINC000002202919	203930419	/nfs/dbraw/zinc/93/04/19/203930419.db2.gz	JZMIQJZOELEQMM-UHFFFAOYSA-N	-2	0	397.343	2.445	50	5		GEBARL
O=C([O-])c1[nH]c2ccc([N+](=O)[O-])cc2c1CCNC(=O)c1ccccc1C(=O)[O-]	ZINC000001825234	570820158	/nfs/dbraw/zinc/82/01/58/570820158.db2.gz	SXXUZTMZMXJAMD-UHFFFAOYSA-N	-2	0	397.343	2.445	50	5		GEBARL
Cc1ccc(C(=O)[O-])cc1-c1ccc(C=Cc2[nH]c(=O)[n-]c(=O)c2[N+](=O)[O-])o1	ZINC000004699530	570843675	/nfs/dbraw/zinc/84/36/75/570843675.db2.gz	DWLICOKWFDYONO-GQCTYLIASA-N	-2	0	383.316	2.408	50	5		GEBARL
O=S(=O)([O-])c1cc(S(=O)(=O)[O-])c2ccc3c(O)cc(O)c4ccc1c2c43	ZINC000002570006	209369301	/nfs/dbraw/zinc/36/93/01/209369301.db2.gz	GQLRLYZETPCMLD-UHFFFAOYSA-N	-2	0	394.382	2.489	50	5		GEBARL
COc1ccc([N+](=O)[O-])cc1[N-]S(=O)(=O)c1cc(C(=O)[O-])ccc1OC	ZINC000003269673	601316764	/nfs/dbraw/zinc/31/67/64/601316764.db2.gz	MBDDAIOGRWGACF-UHFFFAOYSA-N	-2	0	382.350	2.111	50	5		GEBARL