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)[C@H](CCCC[NH3+])NC(=O)[C@H](CO)NC(=O)CCCCCCCCCC[NH3+])C(N)=O	ZINC000013761907	562990274	/nfs/dbraw/zinc/99/02/74/562990274.db2.gz	PBQAKEGJDPYGMJ-FHWLQOOXSA-N	2	0	486.658	-0.463	10	0		JBAERP
NC(=[NH2+])Nc1ccc(O[C@@H]2C[C@H](Oc3ccc(NC(N)=[NH2+])cc3)[C@@H](NC(N)=[NH2+])C[C@H]2NC(N)=[NH2+])cc1	ZINC000058549725	195380179	/nfs/dbraw/zinc/38/01/79/195380179.db2.gz	MBDMLDIYZDMGFF-USTZCAOPSA-N	4	0	496.580	-0.011	10	0	in-vitro	JBAERP