Molecule ID: mol18193
SMILES: O=C(Nc1cccc(OCc2ccc3c(c2)OCO3)c1)C1CCN(c2ccncc2)CC1
InChI: InChI=1S/C25H25N3O4/c29-25(19-8-12-28(13-9-19)21-6-10-26-11-7-21)27-20-2-1-3-22(15-20)30-16-18-4-5-23-24(14-18)32-17-31-23/h1-7,10-11,14-15,19H,8-9,12-13,16-17H2,(H,27,29)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.10 | Baltruschat ChEMBL | 1 » 0 |