Molecule ID: mol15844
SMILES: Nc1cn[nH]c1
InChI: InChI=1S/C3H5N3/c4-3-1-5-6-2-3/h1-2H,4H2,(H,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.00 | AttenGpKa training set | 1 » 0 |
| 5.57 | Datawarrior | 1 » 0 |
| 5.57 | AttenGpKa training set | 1 » 0 |
| 5.57 | QSARToolbox | 1 » 0 |
| 5.57 | OCHEM | 1 » 0 |