Molecule ID: mol10763
SMILES: O=C(O)C[Se]c1ccc([N+](=O)[O-])cc1
InChI: InChI=1S/C8H7NO4Se/c10-8(11)5-14-7-3-1-6(2-4-7)9(12)13/h1-4H,5H2,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.43 | IUPAC digitized pKa | 0 » -1 |
| 3.43 | QSARToolbox | 0 » -1 |
| 3.46 | Datawarrior | 0 » -1 |
| 3.46 | OCHEM | 0 » -1 |
| 3.49 | QSARToolbox | 0 » -1 |
| 3.49 | QSARToolbox | 0 » -1 |