Molecule ID: mol2059
SMILES: CC(C)(C)Nc1ccccc1
InChI: InChI=1S/C10H15N/c1-10(2,3)11-9-7-5-4-6-8-9/h4-8,11H,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.37 | QSARToolbox | 1 » 0 |
| 6.74 | QSARToolbox | 1 » 0 |
| 7.00 | IUPAC digitized pKa | 1 » 0 |
| 7.00 | OCHEM | 1 » 0 |
| 7.00 | Hunt | 1 » 0 |
| 7.00 | QSARToolbox | 1 » 0 |
| 7.00 | QSARToolbox | 1 » 0 |
| 7.08 | OCHEM | 1 » 0 |
| 7.10 | QSARToolbox | 1 » 0 |
| 7.10 | QSARToolbox | 1 » 0 |
| 7.10 | IUPAC digitized pKa | 1 » 0 |
| 7.10 | OCHEM | 1 » 0 |
| 7.10 | OCHEM | 1 » 0 |
| 7.15 | Datawarrior | 1 » 0 |
| 7.15 | OCHEM | 1 » 0 |