Molecule ID: mol11114
SMILES: O=S(=O)(O)c1ccc2cccnc2c1O
InChI: InChI=1S/C9H7NO4S/c11-9-7(15(12,13)14)4-3-6-2-1-5-10-8(6)9/h1-5,11H,(H,12,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.34 | IUPAC digitized pKa | 0 » -1 |
| 4.27 | IUPAC digitized pKa | 0 » -1 |
| 7.51 | IUPAC digitized pKa | -1 » -2 |
| 8.76 | IUPAC digitized pKa | -1 » -2 |