smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)[N@H+](C)Cc1nn(-c2ncccc2NC(=O)CCl)c2c1CC[NH2+]C2	ZINC001164680230	719636195	/nfs/dbraw/zinc/63/61/95/719636195.db2.gz	SQRMRTXKBCKKMM-UHFFFAOYSA-N	2	1	376.892	1.931	20	50		GDGDMP
CC(C)[N@@H+](C)Cc1nn(-c2ncccc2NC(=O)CCl)c2c1CC[NH2+]C2	ZINC001164680230	719636198	/nfs/dbraw/zinc/63/61/98/719636198.db2.gz	SQRMRTXKBCKKMM-UHFFFAOYSA-N	2	1	376.892	1.931	20	50		GDGDMP
CC(C)[N@H+](C)Cc1nn(-c2ccc(NC(=O)CCl)cn2)c2c1CC[NH2+]C2	ZINC001164680618	719646795	/nfs/dbraw/zinc/64/67/95/719646795.db2.gz	YQKLFPBZWZSOMJ-UHFFFAOYSA-N	2	1	376.892	1.931	20	50		GDGDMP
CC(C)[N@@H+](C)Cc1nn(-c2ccc(NC(=O)CCl)cn2)c2c1CC[NH2+]C2	ZINC001164680618	719646801	/nfs/dbraw/zinc/64/68/01/719646801.db2.gz	YQKLFPBZWZSOMJ-UHFFFAOYSA-N	2	1	376.892	1.931	20	50		GDGDMP