Molecule ID: mol6556
SMILES: O=S(=O)(O)c1ccncc1
InChI: InChI=1S/C5H5NO3S/c7-10(8,9)5-1-3-6-4-2-5/h1-4H,(H,7,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.14 | QSARToolbox | 0 » -1 |
| 3.44 | IUPAC digitized pKa | 0 » -1 |
| 3.44 | Datawarrior | 0 » -1 |
| 3.44 | OCHEM | 0 » -1 |
| 3.44 | QSARToolbox | 0 » -1 |
| 3.44 | QSARToolbox | 0 » -1 |
| 3.44 | OCHEM | 0 » -1 |