Molecule ID: mol17101
SMILES: O=C(c1ccc(Cl)cc1)c1ccc(OC2CN3CCC2CC3)cc1
InChI: InChI=1S/C20H20ClNO2/c21-17-5-1-15(2-6-17)20(23)16-3-7-18(8-4-16)24-19-13-22-11-9-14(19)10-12-22/h1-8,14,19H,9-13H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.10 | OCHEM | 1 » 0 |
| 9.10 | OCHEM | 1 » 0 |
| 9.10 | Baltruschat ChEMBL | 1 » 0 |