Molecule ID: mol257
SMILES: OC(CNCc1ccccc1)C(F)(F)F
InChI: InChI=1S/C10H12F3NO/c11-10(12,13)9(15)7-14-6-8-4-2-1-3-5-8/h1-5,9,14-15H,6-7H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.30 | OCHEM | 1 » 0 |
| 7.30 | Settimo | 1 » 0 |
| 7.30 | AttenGpKa training set | 1 » 0 |