Molecule ID: mol13988
SMILES: CN1C(=O)NCc2[nH]cnc21
InChI: InChI=1S/C6H8N4O/c1-10-5-4(8-3-9-5)2-7-6(10)11/h3H,2H2,1H3,(H,7,11)(H,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 11.10 | Datawarrior | 0 » -1 |
| 11.10 | OCHEM | 0 » -1 |
| 11.10 | QSARToolbox | 0 » -1 |