Molecule ID: mol8984
SMILES: C#CCO
InChI: InChI=1S/C3H4O/c1-2-3-4/h1,4H,3H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 13.25 | QSARToolbox | 0 » -1 |
| 13.25 | QSARToolbox | 0 » -1 |
| 13.28 | QSARToolbox | 0 » -1 |
| 13.28 | QSARToolbox | 0 » -1 |
| 13.28 | Datawarrior | 0 » -1 |
| 13.28 | OCHEM | 0 » -1 |
| 13.30 | QSARToolbox | 0 » -1 |
| 13.55 | IUPAC digitized pKa | 0 » -1 |
| 13.55 | AttenGpKa training set | 0 » -1 |
| 13.55 | QSARToolbox | 0 » -1 |
| 13.55 | QSARToolbox | 0 » -1 |
| 13.60 | QSARToolbox | 0 » -1 |