smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cc(O)cc2oc3cc(O)ccc3c(=O)c12 ZINC000072319922 176368517 /nfs/dbraw/zinc/36/85/17/176368517.db2.gz VLJAMZIVBOJAKI-UHFFFAOYSA-N -2 2 258.229 2.366 40 5 biogenic,in-vitro CEBBLL