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+]Nc2c3ccccc3[nH+]c3ccccc32)cc1 ZINC000016186378 563805543 /nfs/dbraw/zinc/80/55/43/563805543.db2.gz WQLMTASFRNDMRQ-HZHRSRAPSA-N 2 2 340.430 4.900 40 30 EJEBLP CCN(CC)c1ccc(C=[NH+]Nc2cc(C)[nH+]c3ccccc23)cc1 ZINC000005006927 210358594 /nfs/dbraw/zinc/35/85/94/210358594.db2.gz KXINCHAAEYARAW-PXLXIMEGSA-N 2 2 332.451 4.835 40 30 EJEBLP