smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCC[N+]3([O-])CCCC[C@@H]3CCl)ccc(NCC[N+]3([O-])CCCC[C@@H]3CCl)c21	ZINC000044145940	717129366	/nfs/dbraw/zinc/12/93/66/717129366.db2.gz	GXYOPEPYCSBIOP-WCGYVKKDSA-N	0	0	621.562	4.909	1	50		KJGFRN
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCC[N+]3([O-])CCCC[C@H]3CCl)ccc(NCC[N+]3([O-])CCCC[C@@H]3CCl)c21	ZINC000044145945	717129460	/nfs/dbraw/zinc/12/94/60/717129460.db2.gz	GXYOPEPYCSBIOP-YUYUOCFFSA-N	0	0	621.562	4.909	1	50		KJGFRN
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCC[N@@+]3([O-])CCCC[C@H]3CCl)ccc(NCC[N@+]3([O-])CCCC[C@@H]3CCl)c21	ZINC000253664632	717167114	/nfs/dbraw/zinc/16/71/14/717167114.db2.gz	GXYOPEPYCSBIOP-FTOOOKMSSA-N	0	0	621.562	4.909	1	50		KJGFRN
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCC[N@@+]3([O-])CCCC[C@@H]3CCl)ccc(NCC[N@+]3([O-])CCCC[C@@H]3CCl)c21	ZINC000253664635	717167049	/nfs/dbraw/zinc/16/70/49/717167049.db2.gz	GXYOPEPYCSBIOP-HJCZORRFSA-N	0	0	621.562	4.909	1	50		KJGFRN
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCC[N@+]3([O-])CCCC[C@@H]3CCl)ccc(NCC[N@+]3([O-])CCCC[C@@H]3CCl)c21	ZINC000253664639	717167191	/nfs/dbraw/zinc/16/71/91/717167191.db2.gz	GXYOPEPYCSBIOP-KPUFPDCSSA-N	0	0	621.562	4.909	1	50		KJGFRN
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCC[N@+]3([O-])CCCC[C@H]3CCl)ccc(NCC[N@+]3([O-])CCCC[C@@H]3CCl)c21	ZINC000253664643	717167210	/nfs/dbraw/zinc/16/72/10/717167210.db2.gz	GXYOPEPYCSBIOP-WFGBTPDLSA-N	0	0	621.562	4.909	1	50		KJGFRN