smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
NC(=[NH2+])NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC(=O)N1)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000013537616	553469508	/nfs/dbraw/zinc/46/95/08/553469508.db2.gz	WPVINHLVHHPBMK-ULQDDVLXSA-N	1	0	502.532	-0.449	40	5		KBBBRO
C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000071788494	553639533	/nfs/dbraw/zinc/63/95/33/553639533.db2.gz	OVDKLYABPRRXIH-WBAXXEDZSA-N	1	0	593.642	-0.055	40	5		KBBBRO
NC(=[NH2+])NCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCC(=O)N1)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000644163818	1066200781	/nfs/dbraw/zinc/20/07/81/1066200781.db2.gz	WPVINHLVHHPBMK-BBWFWOEESA-N	1	0	502.532	-0.449	40	5		KBBBRO
NC(=[NH2+])NCCC[C@H](NC(=O)[C@H]1CCCN1C(=O)[C@H]1CCC(=O)N1)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000644163819	1066230149	/nfs/dbraw/zinc/23/01/49/1066230149.db2.gz	WPVINHLVHHPBMK-GVDBMIGSSA-N	1	0	502.532	-0.449	40	5		KBBBRO