Molecule ID: mol2260
SMILES: CN(C)Cc1ccccc1
InChI: InChI=1S/C9H13N/c1-10(2)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.91 | QSARToolbox | 1 » 0 |
| 8.91 | QSARToolbox | 1 » 0 |
| 8.91 | IUPAC digitized pKa | 1 » 0 |
| 8.91 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 8.91 | OCHEM | 1 » 0 |
| 8.91 | OCHEM | 1 » 0 |
| 8.91 | Hunt | 1 » 0 |
| 8.91 | OCHEM | 1 » 0 |
| 8.92 | QSARToolbox | 1 » 0 |
| 8.96 | AttenGpKa training set | 1 » 0 |
| 8.97 | OCHEM | 1 » 0 |
| 8.97 | Datawarrior | 1 » 0 |
| 8.97 | OCHEM | 1 » 0 |
| 9.00 | QSARToolbox | 1 » 0 |
| 9.02 | OCHEM | 1 » 0 |
| 9.02 | OCHEM | 1 » 0 |
| 9.02 | Baltruschat ChEMBL | 1 » 0 |
| 9.03 | QSARToolbox | 1 » 0 |
| 9.03 | IUPAC digitized pKa | 1 » 0 |
| 9.07 | QSARToolbox | 1 » 0 |
| 9.30 | QSARToolbox | 1 » 0 |