Molecule ID: mol2369
SMILES: C=CCN
InChI: InChI=1S/C3H7N/c1-2-3-4/h2H,1,3-4H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.49 | QSARToolbox | 1 » 0 |
| 9.49 | QSARToolbox | 1 » 0 |
| 9.49 | IUPAC digitized pKa | 1 » 0 |
| 9.49 | OCHEM | 1 » 0 |
| 9.49 | Hunt | 1 » 0 |
| 9.51 | AttenGpKa training set | 1 » 0 |
| 9.51 | OCHEM | 1 » 0 |
| 9.53 | QSARToolbox | 1 » 0 |
| 9.53 | IUPAC digitized pKa | 1 » 0 |
| 9.69 | OCHEM | 1 » 0 |
| 9.69 | OCHEM | 1 » 0 |
| 9.70 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 9.70 | OCHEM | 1 » 0 |
| 9.70 | OCHEM | 1 » 0 |
| 9.74 | OCHEM | 1 » 0 |
| 9.74 | Datawarrior | 1 » 0 |
| 9.97 | QSARToolbox | 1 » 0 |