smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1NN(c2ccc(Cl)cc2)C(=O)/C1=C\c1cc(Br)ccc1O ZINC000016427987 210188502 /nfs/dbraw/zinc/18/85/02/210188502.db2.gz UWWMJRXAVBWDKW-JYRVWZFOSA-N -2 2 393.624 3.270 40 10 GGCBLL