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)(C)NC(=O)[C@@H]1C[N@@H+](Cc2cccnc2)CCN1C[C@@H](O)[C@H](F)[C@@H](Cc1ccccc1)C(=O)N[C@H]1c2ccccc2C[C@H]1O	ZINC000161446627	562849196	/nfs/dbraw/zinc/84/91/96/562849196.db2.gz	KFBCFYNJFLJDPD-BDMNMGLZSA-N	1	2	631.793	2.815	1	70		KFIFLO
CC(C)(C)NC(=O)[C@@H]1C[N@H+](Cc2cccnc2)CCN1C[C@@H](O)[C@H](F)[C@@H](Cc1ccccc1)C(=O)N[C@H]1c2ccccc2C[C@H]1O	ZINC000161446627	562849195	/nfs/dbraw/zinc/84/91/95/562849195.db2.gz	KFBCFYNJFLJDPD-BDMNMGLZSA-N	1	2	631.793	2.815	1	70		KFIFLO
C[NH+]1CCN(C(=O)C[C@H](NC(=O)C=Cc2cc(Cl)ccc2-n2cnnn2)c2nc(-c3ccc4[nH]c(=O)cc(O)c4c3)c(Cl)[nH]2)CC1	ZINC000217356091	562877539	/nfs/dbraw/zinc/87/75/39/562877539.db2.gz	NBMJTOOHXJGJNZ-RJOTYRNVSA-N	1	2	663.526	2.941	1	70	in-vitro	KFIFLO
C[NH+]1CCN(C(=O)C[C@H](NC(=O)C=Cc2cc(Cl)ccc2-n2cnnn2)c2nc(Cl)c(-c3ccc4[nH]c(=O)cc(O)c4c3)[nH]2)CC1	ZINC000217356091	562877538	/nfs/dbraw/zinc/87/75/38/562877538.db2.gz	NBMJTOOHXJGJNZ-RJOTYRNVSA-N	1	2	663.526	2.941	1	70	in-vitro	KFIFLO