Molecule ID: mol33032
SMILES: CC(C(N)C(=O)O)C(F)(F)F
InChI: InChI=1S/C5H8F3NO2/c1-2(5(6,7)8)3(9)4(10)11/h2-3H,9H2,1H3,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.54 | QSARToolbox | 1 » 0 |
| 1.54 | OCHEM | 1 » 0 |
| 1.54 | QSARToolbox | 1 » 0 |
| 1.54 | QSARToolbox | 1 » 0 |
| 8.10 | OCHEM | 0 » -1 |
| 8.98 | QSARToolbox | 0 » -1 |