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@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CO)C(=O)NCC(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)N[C@@H](CC(C)C)C(N)=O	ZINC000026468553	553818575	/nfs/dbraw/zinc/81/85/75/553818575.db2.gz	SGPMJRPYYIJZPC-JYAZKYGWSA-N	1	1	656.830	-2.961	50	30	in-vitro	KAEAMO
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=[NH2+])C(N)=O	ZINC000027076581	553824883	/nfs/dbraw/zinc/82/48/83/553824883.db2.gz	CDBPTZOOUNAWQA-LSBAASHUSA-N	1	1	633.795	-1.881	50	30		KAEAMO