Molecule ID: mol2372
SMILES: C=CCN(C)C
InChI: InChI=1S/C5H11N/c1-4-5-6(2)3/h4H,1,5H2,2-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.64 | IUPAC digitized pKa | 1 » 0 |
| 8.64 | OCHEM | 1 » 0 |
| 8.64 | Hunt | 1 » 0 |
| 8.64 | OCHEM | 1 » 0 |
| 8.72 | Datawarrior | 1 » 0 |
| 8.72 | OCHEM | 1 » 0 |
| 8.78 | AttenGpKa training set | 1 » 0 |