smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(F)cc(-c2nc3cc4ccccc4cc3c(=O)[n-]2)c1 ZINC000431181877 338125174 /nfs/dbraw/zinc/12/51/74/338125174.db2.gz UAPYEFRRXFNQIG-UHFFFAOYSA-N -1 3 304.324 4.603 20 5 DJBDHM