Molecule ID: mol29520
SMILES: NC(=O)NC1NC(=O)NC1=O
InChI: InChI=1S/C4H6N4O3/c5-3(10)6-1-2(9)8-4(11)7-1/h1H,(H3,5,6,10)(H2,7,8,9,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.47 | AttenGpKa training set | 0 » -1 |
| 8.93 | QSARToolbox | 0 » -1 |
| 8.93 | QSARToolbox | 0 » -1 |
| 8.96 | QSARToolbox | 0 » -1 |