smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1NNC=C1C(=O)[N-]C(=O)NC1=O	ZINC000059490004	570659093	/nfs/dbraw/zinc/65/90/93/570659093.db2.gz	HZXULUQSDXEYDA-UHFFFAOYSA-N	-1	0	398.357	-0.989	40	10		GBCBRM
Cn1c(O)c(C=CC=C2C(=O)N(C)C(=S)N(C)C2=O)c(=O)n(C)c1=S	ZINC000100256860	211384984	/nfs/dbraw/zinc/38/49/84/211384984.db2.gz	QYMJOSXSAMGWEZ-AATRIKPKSA-N	-1	0	380.451	-0.484	40	10		GBCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=CNC34CN5CN(CN(C5)C3)C4)C2=O)cc1C	ZINC000408533046	231052590	/nfs/dbraw/zinc/05/25/90/231052590.db2.gz	NYJMLYMGXCKWOL-OMCISZLKSA-N	-1	0	396.451	-0.082	40	10		GBCBRM