smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc2c(c1)[n+]([O-])c(C(=O)C=C(NNC(=O)C[N+](C)(C)C)C(=O)Nc1cccc(C)c1C)c(C)[n+]2[O-]	ZINC000005722135	717101072	/nfs/dbraw/zinc/10/10/72/717101072.db2.gz	IFRUVDCHBULDJM-UHFFFAOYSA-O	1	0	537.597	1.430	40	50		KDGBRO
COc1ccc(NC(=O)C(=CC2=Nc3ccc([N+](=O)[O-])cc3N[C@H]2O)NNC(=O)C[N+](C)(C)C)c(OC)c1	ZINC000018176012	717113029	/nfs/dbraw/zinc/11/30/29/717113029.db2.gz	ROOBYMUBDLGLEI-QHCPKHFHSA-O	1	0	528.546	1.636	40	50		KDGBRO
COc1ccc(NC(=O)C(=CC2=Nc3ccc([N+](=O)[O-])cc3N[C@@H]2O)NNC(=O)C[N+](C)(C)C)c(OC)c1	ZINC000102956279	717146137	/nfs/dbraw/zinc/14/61/37/717146137.db2.gz	ROOBYMUBDLGLEI-HSZRJFAPSA-O	1	0	528.546	1.636	40	50		KDGBRO