Molecule ID: mol8032
SMILES: CC(=O)CC1=Nc2c(O)nc(N)nc2N(C)C1
InChI: InChI=1S/C10H13N5O2/c1-5(16)3-6-4-15(2)8-7(12-6)9(17)14-10(11)13-8/h3-4H2,1-2H3,(H3,11,13,14,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -1.35 | IUPAC digitized pKa | 3 » 2 |
| 8.36 | IUPAC digitized pKa | 0 » -1 |