smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOC(=O)/C=C/c1ccc([O-])c(F)c1 ZINC000147924268 368394486 /nfs/dbraw/zinc/39/44/86/368394486.db2.gz LHBPBDSDTOJEGB-GQCTYLIASA-N -1 3 210.204 2.108 30 0 BEACHM