smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
NCC(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)NCC(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)[O-]	ZINC000003934112	552423031	/nfs/dbraw/zinc/42/30/31/552423031.db2.gz	NTEDOEBWPRVVSG-XUXIUFHCSA-N	-1	1	587.591	-5.678	20	0		KAADMM