Molecule ID: mol37747
SMILES: N[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)O
InChI: InChI=1S/C11H14N2O4/c12-9(11(17)13-6-10(15)16)5-7-1-3-8(14)4-2-7/h1-4,9,14H,5-6,12H2,(H,13,17)(H,15,16)/t9-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.13 | QSARToolbox | 1 » 0 |
| 7.54 | QSARToolbox | 0 » -1 |