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]1OC[C@@H](O)[C@H](O)[C@H]1O)c1ccc([O-])c(O)c1 ZINC000006091830 170175028 /nfs/dbraw/zinc/17/50/28/170175028.db2.gz VWQASRWQZBVNEI-KLBPJQLPSA-N -1 3 286.236 -1.306 1 10 biogenic,in-vitro CACFHM