Molecule ID: mol21176
SMILES: NS(=O)(=O)c1cc(S(=O)(=O)c2ccc(O)cc2)cs1
InChI: InChI=1S/C10H9NO5S3/c11-19(15,16)10-5-9(6-17-10)18(13,14)8-3-1-7(12)2-4-8/h1-6,12H,(H2,11,15,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.46 | Baltruschat ChEMBL | 0 » -1 |
| 9.20 | Baltruschat ChEMBL | -1 » -2 |