Molecule ID: mol36141
SMILES: O=C(O)CN(CC(=O)O)c1ccccc1OCCCCOc1ccccc1N(CC(=O)O)CC(=O)O
InChI: InChI=1S/C24H28N2O10/c27-21(28)13-25(14-22(29)30)17-7-1-3-9-19(17)35-11-5-6-12-36-20-10-4-2-8-18(20)26(15-23(31)32)16-24(33)34/h1-4,7-10H,5-6,11-16H2,(H,27,28)(H,29,30)(H,31,32)(H,33,34)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.93 | QSARToolbox | 0 » -1 |