smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1ccc(-n2ncc(-c3nn[n-]n3)n2)c([N+](=O)[O-])c1	ZINC000016385893	415155067	/nfs/dbraw/zinc/15/50/67/415155067.db2.gz	ZNDXTGURLNGMCD-UHFFFAOYSA-N	-1	1	303.198	0.264	40	5		DCBBMM
O=C([O-])CN1C(=O)N/C(=C/c2cc(O)ccc2[N+](=O)[O-])C1=O	ZINC000408590257	239272816	/nfs/dbraw/zinc/27/28/16/239272816.db2.gz	GZRXWPGMXSQLAA-XBXARRHUSA-N	-1	1	307.218	0.278	40	5		DCBBMM
O=[N+]([O-])c1nnc(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)[n-]1	ZINC000059417378	184138555	/nfs/dbraw/zinc/13/85/55/184138555.db2.gz	VEQNOLFZEISNIE-UHFFFAOYSA-N	-1	1	313.251	0.595	40	5		DCBBMM
O=[N+]([O-])c1n[n-]c(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)n1	ZINC000059417378	184138557	/nfs/dbraw/zinc/13/85/57/184138557.db2.gz	VEQNOLFZEISNIE-UHFFFAOYSA-N	-1	1	313.251	0.595	40	5		DCBBMM
NC(=O)c1ccc(Sc2nc(N)cc(=O)[n-]2)c([N+](=O)[O-])c1	ZINC000016384434	545643268	/nfs/dbraw/zinc/64/32/68/545643268.db2.gz	YSJVULZBBVKSIJ-UHFFFAOYSA-N	-1	1	307.291	0.510	40	5		DCBBMM