smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+][C@@H](CCc1c[n+](C[C@H](O)CC[C@H]([NH3+])C(=O)[O-])cc([O-])c1C[C@H]([NH3+])C(=O)[O-])C(=O)[O-]	ZINC000012494427	571694354	/nfs/dbraw/zinc/69/43/54/571694354.db2.gz	LCYXYLLJXMAEMT-SAXRGWBVSA-O	0	0	429.450	-2.468	1	10	endogenous,in-man	IACFRN
O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1O[C@@H](O[C@@H]2COC(=O)C2)[C@H](O)[C@@H](O)[C@@H]1O	ZINC000084691014	563176570	/nfs/dbraw/zinc/17/65/70/563176570.db2.gz	CYEFUTNNSBRMEB-ICCSCHITSA-N	0	0	426.374	-1.206	1	10		IACFRN