smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])N1CCCC[C@@H]1CCOc1ccccc1 ZINC000217644252 371991073 /nfs/dbraw/zinc/99/10/73/371991073.db2.gz FWNDZZXMFTUECS-GFCCVEGCSA-N -1 0 249.310 2.988 50 70 BFIARM