Molecule ID: mol18202
SMILES: O=C(Nc1cccc(OCc2ccc(F)cc2)c1)C1CCN(c2ccccn2)CC1
InChI: InChI=1S/C24H24FN3O2/c25-20-9-7-18(8-10-20)17-30-22-5-3-4-21(16-22)27-24(29)19-11-14-28(15-12-19)23-6-1-2-13-26-23/h1-10,13,16,19H,11-12,14-15,17H2,(H,27,29)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.50 | Baltruschat ChEMBL | 1 » 0 |