smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1nc2c(c(=O)[n-]1)n(Cc1ccc([N+](=O)[O-])cc1)c(=O)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000004650642	562943494	/nfs/dbraw/zinc/94/34/94/562943494.db2.gz	MHUMNLRAUPJBBC-SDBHATRESA-N	-1	1	434.365	-1.964	1	5		IABFMM
Nc1nc2c(c(=O)[n-]1)n(Cc1ccc([N+](=O)[O-])cc1)c(=O)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O	ZINC000027109909	563040124	/nfs/dbraw/zinc/04/01/24/563040124.db2.gz	MHUMNLRAUPJBBC-AYIJCJCZSA-N	-1	1	434.365	-1.964	1	5		IABFMM
Nc1nc2c(c(=O)[n-]1)n(Cc1ccc([N+](=O)[O-])cc1)c(=O)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O	ZINC000027109910	563040102	/nfs/dbraw/zinc/04/01/02/563040102.db2.gz	MHUMNLRAUPJBBC-NFOTXUCKSA-N	-1	1	434.365	-1.964	1	5		IABFMM
Nc1nc2c(c(=O)[n-]1)n(Cc1ccc([N+](=O)[O-])cc1)c(=O)n2[C@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000027109914	563040086	/nfs/dbraw/zinc/04/00/86/563040086.db2.gz	MHUMNLRAUPJBBC-CGEWXTDFSA-N	-1	1	434.365	-1.964	1	5		IABFMM