Molecule ID: mol4423
SMILES: Cc1cc(O)c2ncccc2c1S(=O)(=O)O
InChI: InChI=1S/C10H9NO4S/c1-6-5-8(12)9-7(3-2-4-11-9)10(6)16(13,14)15/h2-5,12H,1H3,(H,13,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.20 | IUPAC digitized pKa | 0 » -1 |
| 8.70 | IUPAC digitized pKa | -1 » -2 |
| 8.70 | OCHEM | -1 » -2 |