Molecule ID: mol373
SMILES: FC(F)(F)c1cccc(N2CCN(C3C4CC5CC(C4)CC3C5)CC2)c1
InChI: InChI=1S/C21H27F3N2/c22-21(23,24)18-2-1-3-19(13-18)25-4-6-26(7-5-25)20-16-9-14-8-15(11-16)12-17(20)10-14/h1-3,13-17,20H,4-12H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.45 | OCHEM | 1 » 0 |
| 7.45 | AvLiLuMoVe | 1 » 0 |
| 7.45 | Settimo | 1 » 0 |