Molecule ID: mol18342
SMILES: CCOC(=O)C1(c2ccccc2)CCN(CC(F)(F)F)CC1
InChI: InChI=1S/C16H20F3NO2/c1-2-22-14(21)15(13-6-4-3-5-7-13)8-10-20(11-9-15)12-16(17,18)19/h3-7H,2,8-12H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.13 | OCHEM | 1 » 0 |
| 3.13 | Baltruschat ChEMBL | 1 » 0 |
| 3.13 | QSARToolbox | 1 » 0 |