Molecule ID: mol17438
SMILES: CCN(CC)CCOc1ccc(C(=O)N2C/C(=C\c3ccc(C)cc3)C(=O)/C(=C/c3ccc(C)cc3)C2)cc1
InChI: InChI=1S/C34H38N2O3/c1-5-35(6-2)19-20-39-32-17-15-29(16-18-32)34(38)36-23-30(21-27-11-7-25(3)8-12-27)33(37)31(24-36)22-28-13-9-26(4)10-14-28/h7-18,21-22H,5-6,19-20,23-24H2,1-4H3/b30-21+,31-22+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.84 | Baltruschat ChEMBL | 1 » 0 |