Molecule ID: mol32708
SMILES: CC(CCCNCc1ccccc1)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C
InChI: InChI=1S/C31H49NO2/c1-21(8-7-17-32-20-22-9-5-4-6-10-22)25-11-12-26-29-27(14-16-31(25,26)3)30(2)15-13-24(33)18-23(30)19-28(29)34/h4-6,9-10,21,23-29,32-34H,7-8,11-20H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.06 | OCHEM | 1 » 0 |