Molecule ID: mol15283
SMILES: CCc1cc(Cl)n(C)c2nc3ccccc3c1-2
InChI: InChI=1S/C14H13ClN2/c1-3-9-8-12(15)17(2)14-13(9)10-6-4-5-7-11(10)16-14/h4-8H,3H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.46 | Datawarrior | 1 » 0 |
| 7.46 | OCHEM | 1 » 0 |
| 7.46 | QSARToolbox | 1 » 0 |