Molecule ID: mol8556
SMILES: CC(=O)N[C@@H](CCCCN)C(=O)O
InChI: InChI=1S/C8H16N2O3/c1-6(11)10-7(8(12)13)4-2-3-5-9/h7H,2-5,9H2,1H3,(H,10,11)(H,12,13)/t7-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.25 | QSARToolbox | 0 » -1 |
| 10.53 | IUPAC digitized pKa | 0 » -1 |