smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H](NC(=O)c1ccccc1N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(N)=O	ZINC000049841135	562688052	/nfs/dbraw/zinc/68/80/52/562688052.db2.gz	GQHJUPYTVIBDGN-ZEWNOJEFSA-N	-1	2	684.663	-1.720	1	5		KABFLM
C[C@@H](O)[C@H](NC(=O)CNC(=O)CNC(=O)c1ccccc1N)C(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(N)=O	ZINC000049841345	562688260	/nfs/dbraw/zinc/68/82/60/562688260.db2.gz	WILIYZHVZDCXKO-USKWEPLOSA-N	-1	2	674.624	-3.234	1	5		KABFLM
CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)c1ccccc1N)C(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(N)=O	ZINC000049898495	562692614	/nfs/dbraw/zinc/69/26/14/562692614.db2.gz	QWADNABARNNXEW-WVESVMEASA-N	-1	2	700.706	-1.181	1	5		KABFLM
CC(C)C[C@H](NC(=O)[C@H](CC(=O)[O-])NC(=O)c1ccccc1N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(N)=O	ZINC000049898832	562692903	/nfs/dbraw/zinc/69/29/03/562692903.db2.gz	KRUVGNFVCQSIOK-TUFLPTIASA-N	-1	2	659.653	-1.324	1	5		KABFLM
C[C@@H](O)[C@H](NC(=O)[C@H](CC(=O)[O-])NC(=O)c1ccccc1N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(N)=O	ZINC000095540765	562756004	/nfs/dbraw/zinc/75/60/04/562756004.db2.gz	FOYLITSMTIHSOC-OEKRXHEWSA-N	-1	2	794.775	-2.261	1	5		KABFLM
CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(=O)[O-])NC(=O)c1ccccc1N)C(=O)N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(N)=O	ZINC000095615912	562787635	/nfs/dbraw/zinc/78/76/35/562787635.db2.gz	IWOFZZHNFRJADQ-KEOOTSPTSA-N	-1	2	783.796	-1.449	1	5		KABFLM
C[C@@H](O)[C@H](NC(=O)[C@H](CC(=O)[O-])NC(=O)[C@H](C)NC(=O)c1ccccc1N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)C(N)=O	ZINC000095615967	562787666	/nfs/dbraw/zinc/78/76/66/562787666.db2.gz	SAOCXKIUVSNORW-RMBLSVSMSA-N	-1	2	778.776	-1.234	1	5		KABFLM