smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+](C)[C@@H]1C([O-])=C(C(=O)NCN2CC[NH+](CCO)CC2)C(=O)[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4[C@@](C)(O)[C@H]3C[C@@H]12	ZINC000022463289	561759439	/nfs/dbraw/zinc/75/94/39/561759439.db2.gz	XATZHCXBMKRRDO-REHNUXHNSA-N	0	2	586.642	-1.016	10	30	in-man	KAEELN