smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(=O)c1ccc2c(c1[O-])[C@@H](c1ccc([O-])c(Cl)c1)CC(=O)O2 ZINC000217657967 273497177 /nfs/dbraw/zinc/49/71/77/273497177.db2.gz LJDDAQUPGBRPBA-LLVKDONJSA-N -2 3 332.739 3.395 50 70 biogenic EGIAHL CC(=O)c1ccc2c(c1[O-])[C@H](c1ccc([O-])c(Cl)c1)CC(=O)O2 ZINC000217657878 456033298 /nfs/dbraw/zinc/03/32/98/456033298.db2.gz LJDDAQUPGBRPBA-NSHDSACASA-N -2 3 332.739 3.395 50 70 biogenic EGIAHL