Molecule ID: mol7044
SMILES: CN(C)c1nc(N)nc(O)c1[N+](=O)[O-]
InChI: InChI=1S/C6H9N5O3/c1-10(2)4-3(11(13)14)5(12)9-6(7)8-4/h1-2H3,(H3,7,8,9,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -0.62 | IUPAC digitized pKa | 1 » 0 |
| 8.53 | IUPAC digitized pKa | 0 » -1 |