smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC1(C)C=C(Nc2ccccc2)C=CC1 ZINC000205468451 344373754 /nfs/dbraw/zinc/37/37/54/344373754.db2.gz FYCQCJFBFQYHPT-UHFFFAOYSA-N 0 1 199.297 3.969 2 0 AHAFMN