smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=NC1([N+](=O)[O-])C2(C(=O)[O-])CC3(C(=O)[O-])CC1(C(=O)[O-])CC(C(=O)[O-])(C2)C3(N=O)[N+](=O)[O-]	ZINC000009008686	554862791	/nfs/dbraw/zinc/86/27/91/554862791.db2.gz	RPZWFYAHYBLJFU-UHFFFAOYSA-N	-4	0	460.264	-0.650	50	5		JBBARL
O=c1[nH]c(=S)[nH]c([O-])c1C(c1ccc(Cl)c([N+](=O)[O-])c1)c1c([O-])[nH]c(=S)[nH]c1=O	ZINC000100530765	569763897	/nfs/dbraw/zinc/76/38/97/569763897.db2.gz	NSNAVCIEDPAOFT-UHFFFAOYSA-N	-2	0	455.861	-0.374	50	5		JBBARL