Molecule ID: mol7140
SMILES: CN(C)c1nc(O)c([N+](=O)[O-])c(N(C)C)n1
InChI: InChI=1S/C8H13N5O3/c1-11(2)6-5(13(15)16)7(14)10-8(9-6)12(3)4/h1-4H3,(H,9,10,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -1.59 | IUPAC digitized pKa | 2 » 1 |
| 8.52 | IUPAC digitized pKa | 0 » -1 |