Molecule ID: mol1170
SMILES: NCc1c(F)c(F)c(F)c(F)c1F
InChI: InChI=1S/C7H4F5N/c8-3-2(1-13)4(9)6(11)7(12)5(3)10/h1,13H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.67 | IUPAC digitized pKa | 1 » 0 |
| 7.67 | Hunt | 1 » 0 |
| 7.67 | OCHEM | 1 » 0 |
| 7.67 | QSARToolbox | 1 » 0 |
| 7.70 | QSARToolbox | 1 » 0 |