smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(-c2nnc([C@@H](C)[N@H+]3CCC[C@H](c4cc[nH]n4)C3)o2)cc1C ZINC000160940503 567837450 /nfs/dbraw/zinc/83/74/50/567837450.db2.gz BMNZRUWHKKOUJI-WBVHZDCISA-N 1 1 351.454 4.017 20 70 FIIDMO Cc1ccc(-c2nnc([C@H](C)[N@H+]3CCC[C@H](c4cc[nH]n4)C3)o2)cc1C ZINC000160940639 567837508 /nfs/dbraw/zinc/83/75/08/567837508.db2.gz BMNZRUWHKKOUJI-RDJZCZTQSA-N 1 1 351.454 4.017 20 70 FIIDMO