smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])[C@H](O)[C@@](O)(Cc1ccc(O)c(O)c1)C(=O)[O-] ZINC000015219221 170659618 /nfs/dbraw/zinc/65/96/18/170659618.db2.gz PHFSBARLASYIFM-KWQFWETISA-N -2 0 272.209 -1.099 1 10 CACFRL