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)C1=C(O)C(=O)N(c2ccc(C)cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000000548112 564022742 /nfs/dbraw/zinc/02/27/42/564022742.db2.gz RMFBDGDNDXDJJH-QGZVFWFLSA-N -1 2 341.794 4.137 50 30 EIEALM O=[N+]([O-])c1ccc(/N=C/c2cc(Cl)cc(Cl)c2[O-])c(O)c1 ZINC000005568335 563540330 /nfs/dbraw/zinc/54/03/30/563540330.db2.gz DCRFKAVJGOOGDF-OMCISZLKSA-N -1 2 327.123 4.063 50 30 EIEALM