Molecule ID: mol31169
SMILES: CC1(C)C(=O)NC(=O)NC1=O
InChI: InChI=1S/C6H8N2O3/c1-6(2)3(9)7-5(11)8-4(6)10/h1-2H3,(H2,7,8,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.14 | AttenGpKa training set | 0 » -1 |
| 8.50 | QSARToolbox | 0 » -1 |
| 8.50 | QSARToolbox | 0 » -1 |
| 8.51 | OCHEM | 0 » -1 |
| 8.51 | OCHEM | 0 » -1 |