Molecule ID: mol5802
SMILES: CNNC
InChI: InChI=1S/C2H8N2/c1-3-4-2/h3-4H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.20 | OCHEM | 2 » 1 |
| 5.20 | Datawarrior | 2 » 1 |
| 7.32 | OCHEM | 1 » 0 |
| 7.49 | AttenGpKa training set | 1 » 0 |
| 7.52 | IUPAC digitized pKa | 1 » 0 |