smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [O-]c1ccc2ccccc2c1CNc1ccc2ccccc2c1 ZINC000001679495 567937496 /nfs/dbraw/zinc/93/74/96/567937496.db2.gz FDLFDSDZJXCTHE-UHFFFAOYSA-N -1 3 299.373 5.311 40 10 CKCBHM