Molecule ID: mol10196
SMILES: Cn1c(=O)[nH]c2[nH]c(=O)n(C)c2c1=O
InChI: InChI=1S/C7H8N4O3/c1-10-3-4(8-6(10)13)9-7(14)11(2)5(3)12/h1-2H3,(H,8,13)(H,9,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.50 | IUPAC digitized pKa | 0 » -1 |
| 10.60 | IUPAC digitized pKa | -1 » -2 |