smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(c2c([O-])n(C)c(=O)n(C)c2=O)c2c([O-])n(C)c(=O)n(C)c2=O)CC1	ZINC000101551691	554796444	/nfs/dbraw/zinc/79/64/44/554796444.db2.gz	YSPISPJXNPHIDP-UHFFFAOYSA-N	-2	0	601.573	-0.741	50	5		KBBARL
CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H](CCC(=O)[O-])C(=O)N[C@H](C(=O)N[C@@H](CC(=O)[O-])C(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](C)O	ZINC000150341012	571458044	/nfs/dbraw/zinc/45/80/44/571458044.db2.gz	FHURKTIGZAIQGR-BQCLNCLCSA-N	-2	0	638.631	-0.741	50	5		KBBARL
Nc1ccccc1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@@H](CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)N1CCC[C@H]1C(=O)[O-]	ZINC000169731040	571559798	/nfs/dbraw/zinc/55/97/98/571559798.db2.gz	GMKYRHRAUUXWAX-ZJZGAYNASA-N	-2	0	730.688	-0.022	50	5		KBBARL