smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=c1cccc2oc3cc([O-])c(O)cc3c([O-])c1-2 ZINC000014822017 344419748 /nfs/dbraw/zinc/41/97/48/344419748.db2.gz SIYGDHCRSSTGRT-UHFFFAOYSA-N -2 0 244.202 2.063 50 10 biogenic BECARL