smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(F)c(C=O)c1[O-] 168640302 344333944 /nfs/dbraw/zinc/33/39/44/344333944.db2.gz SXWPPNKRVPRXCR-UHFFFAOYSA-N -1 1 154.140 1.652 30 0 ADACMM