smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name N#Cc1c(=O)[nH]c(-c2ccc(C(F)(F)F)cc2)cc1C(F)(F)F ZINC000067801406 564134902 /nfs/dbraw/zinc/13/49/02/564134902.db2.gz ABDMCGMIKUFXKS-UHFFFAOYSA-N 0 1 332.203 4.363 30 30 EIECMN