smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)c1ccc(C=[NH+]NC(=[NH+]c2ccccc2)c2ccccc2)cc1 ZINC000006180639 563560411 /nfs/dbraw/zinc/56/04/11/563560411.db2.gz BXKFDIORNNUMHY-HAVVHWLPSA-N 2 2 342.446 4.645 50 30 EJEALP