smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=[N+]([O-])c1cc(Nc2ccc(Cl)cc2[S-])ccc1[O-] ZINC001210398602 1134209382 /nfs/dbraw/zinc/20/93/82/1134209382.db2.gz MUYSOEOFVQSXRY-UHFFFAOYSA-N -2 0 296.735 3.986 20 5 CHBDRL