Molecule ID: mol34463
SMILES: CC(C)CNCC(=O)Nc1ccccc1NC(=O)CN(CC(=O)Nc1ccccc1NC(=O)CNCC(C)C)CC(C)C
InChI: InChI=1S/C32H49N7O4/c1-22(2)15-33-17-29(40)35-25-11-7-9-13-27(25)37-31(42)20-39(19-24(5)6)21-32(43)38-28-14-10-8-12-26(28)36-30(41)18-34-16-23(3)4/h7-14,22-24,33-34H,15-21H2,1-6H3,(H,35,40)(H,36,41)(H,37,42)(H,38,43)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.55 | QSARToolbox | 3 » 2 |