Molecule ID: mol37419
SMILES: NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1
InChI: InChI=1S/C22H25N3O7/c23-20(28)18(12-26)24-21(29)17(11-19(27)31-13-15-7-3-1-4-8-15)25-22(30)32-14-16-9-5-2-6-10-16/h1-10,17-18,26H,11-14H2,(H2,23,28)(H,24,29)(H,25,30)/t17-,18-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.37 | QSARToolbox | 0 » -1 |