smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(OC(=O)[C@@H]([NH3+])C(C)C)c(OC)c2)ccc1OC(=O)[C@@H]([NH3+])C(C)C	ZINC000044360354	562655594	/nfs/dbraw/zinc/65/55/94/562655594.db2.gz	RVFUPBDRJITFOE-ILTOYGKPSA-N	2	2	566.651	3.736	10	30		KHEELP