smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[n+]1ccc(/C=C/c2ccc([N+](C)(C)C)cc2)c2ccccc21 ZINC000036381205 563455509 /nfs/dbraw/zinc/45/55/09/563455509.db2.gz OKZAQNJZMAPHEF-FMIVXFBMSA-N 2 0 304.437 4.031 1 10 DICFRP