Molecule ID: mol8877
SMILES: NNCC(F)(F)C(F)(F)C(F)(F)C(F)F
InChI: InChI=1S/C5H6F8N2/c6-2(7)4(10,11)5(12,13)3(8,9)1-15-14/h2,15H,1,14H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.34 | IUPAC digitized pKa | 1 » 0 |
| 5.34 | OCHEM | 1 » 0 |
| 5.34 | AttenGpKa training set | 1 » 0 |
| 5.34 | QSARToolbox | 1 » 0 |
| 5.34 | QSARToolbox | 1 » 0 |
| 5.34 | QSARToolbox | 1 » 0 |