Molecule ID: mol11399
SMILES: CC(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O
InChI: InChI=1S/C10H14N4O4/c1-6(15)12-4-9(16)14-8(10(17)18)2-7-3-11-5-13-7/h3,5,8H,2,4H2,1H3,(H,11,13)(H,12,15)(H,14,16)(H,17,18)/t8-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.99 | IUPAC digitized pKa | 2 » 1 |
| 7.11 | IUPAC digitized pKa | 0 » -1 |