Molecule ID: mol37394
SMILES: CNC(=O)[C@H](CC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1
InChI: InChI=1S/C20H22N2O5/c1-21-19(24)17(12-18(23)26-13-15-8-4-2-5-9-15)22-20(25)27-14-16-10-6-3-7-11-16/h2-11,17H,12-14H2,1H3,(H,21,24)(H,22,25)/t17-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.40 | QSARToolbox | 0 » -1 |