smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[N+](C)(CC)Cc1cc(/[NH+]=c2\ccn(C)c(C)c2)ccc1[O-] ZINC000043063193 717128469 /nfs/dbraw/zinc/12/84/69/717128469.db2.gz XZLCAPXYBZECRX-CZIZESTLSA-O 1 3 314.453 3.258 1 10 DGCFHO