smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2ON=C(c3cccc([N+](=O)[O-])c3)[C@@H]2C1=O	ZINC000018082928	570799160	/nfs/dbraw/zinc/79/91/60/570799160.db2.gz	JZHLYFJDIGARKY-HOCLYGCPSA-N	-1	2	396.315	2.104	50	5		GEBALM
COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2ON=C(c3ccc(F)cc3)C2=C1O	ZINC000101344337	208392509	/nfs/dbraw/zinc/39/25/09/208392509.db2.gz	AMJOLWGKZJFKNW-GOEBONIOSA-N	-1	2	385.307	2.035	50	5		GEBALM
COc1cc(N2C(=O)[C@@H]3ON=C(c4ccc(F)cc4)C3=C2O)c(C)cc1[N+](=O)[O-]	ZINC000103549467	570886632	/nfs/dbraw/zinc/88/66/32/570886632.db2.gz	AQXWXYAILJBGQP-NVXWUHKLSA-N	-1	2	399.334	2.343	50	5		GEBALM
COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2ON=C(c3ccc(F)cc3)C2=C1O	ZINC000101344338	211399132	/nfs/dbraw/zinc/39/91/32/211399132.db2.gz	AMJOLWGKZJFKNW-GDBMZVCRSA-N	-1	2	385.307	2.035	50	5		GEBALM
Cc1ccc(C(=O)[O-])cc1-c1ccc(C=Cc2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])o1	ZINC000004699530	570843678	/nfs/dbraw/zinc/84/36/78/570843678.db2.gz	DWLICOKWFDYONO-GQCTYLIASA-N	-1	2	383.316	2.408	50	5		GEBALM
Cc1cc(C(=O)[O-])ccc1-c1ccc(C=Cc2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])o1	ZINC000004770742	570975527	/nfs/dbraw/zinc/97/55/27/570975527.db2.gz	VXCYJOZDAPUQLI-ZZXKWVIFSA-N	-1	2	383.316	2.408	50	5		GEBALM
COc1cc(N2C(=O)[C@@H]3ON=C(c4ccc(F)cc4)C3=C2O)c(C)cc1[N+](=O)[O-]	ZINC000103549464	570886504	/nfs/dbraw/zinc/88/65/04/570886504.db2.gz	AQXWXYAILJBGQP-DOTOQJQBSA-N	-1	2	399.334	2.343	50	5		GEBALM
COc1cc(N2C(=O)[C@H]3ON=C(c4ccc(F)cc4)C3=C2O)c(C)cc1[N+](=O)[O-]	ZINC000103549459	570886919	/nfs/dbraw/zinc/88/69/19/570886919.db2.gz	AQXWXYAILJBGQP-RDJZCZTQSA-N	-1	2	399.334	2.343	50	5		GEBALM