Molecule ID: mol8140
SMILES: Cc1nc2c(=O)n(C)c(O)nc2nc1O
InChI: InChI=1S/C8H8N4O3/c1-3-6(13)10-5-4(9-3)7(14)12(2)8(15)11-5/h1-2H3,(H2,10,11,13,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.17 | IUPAC digitized pKa | 0 » -1 |
| 10.42 | IUPAC digitized pKa | -1 » -2 |