Molecule ID: mol37733
SMILES: N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)O
InChI: InChI=1S/C13H15N3O3/c14-10(13(19)16-7-12(17)18)5-8-6-15-11-4-2-1-3-9(8)11/h1-4,6,10,15H,5,7,14H2,(H,16,19)(H,17,18)/t10-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.12 | QSARToolbox | 1 » 0 |
| 5.40 | QSARToolbox | 0 » -1 |