Molecule ID: mol12471
SMILES: CC(=NO)C(=O)NO
InChI: InChI=1S/C3H6N2O3/c1-2(4-7)3(6)5-8/h7-8H,1H3,(H,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.33 | QSARToolbox | 0 » -1 |
| 7.74 | OCHEM | 0 » -1 |
| 7.74 | Datawarrior | 0 » -1 |
| 8.16 | QSARToolbox | 0 » -1 |
| 8.16 | QSARToolbox | 0 » -1 |
| 11.00 | Datawarrior | -1 » -2 |