Molecule ID: mol14136
SMILES: CCn1nnc(CC(=O)O)n1
InChI: InChI=1S/C5H8N4O2/c1-2-9-7-4(6-8-9)3-5(10)11/h2-3H2,1H3,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.45 | Datawarrior | 0 » -1 |
| 3.45 | OCHEM | 0 » -1 |
| 3.45 | AttenGpKa training set | 0 » -1 |
| 3.45 | QSARToolbox | 0 » -1 |