Molecule ID: mol15961
SMILES: CCC(=NO)NO
InChI: InChI=1S/C3H8N2O2/c1-2-3(4-6)5-7/h6-7H,2H2,1H3,(H,4,5)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.15 | Datawarrior | 1 » 0 |
| 5.15 | QSARToolbox | 1 » 0 |
| 5.15 | OCHEM | 1 » 0 |
| 10.70 | QSARToolbox | 0 » -1 |
| 10.70 | Datawarrior | 0 » -1 |
| 10.70 | OCHEM | 0 » -1 |