Molecule ID: mol36173
SMILES: O=C(O)CN1CCOCCOCCN(CC(=O)O)CC(=O)N(Cc2ccccc2)CCN(Cc2ccccc2)C(=O)C1
InChI: InChI=1S/C30H40N4O8/c35-27-21-31(23-29(37)38)13-15-41-17-18-42-16-14-32(24-30(39)40)22-28(36)34(20-26-9-5-2-6-10-26)12-11-33(27)19-25-7-3-1-4-8-25/h1-10H,11-24H2,(H,37,38)(H,39,40)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.98 | QSARToolbox | 0 » -1 |