Molecule ID: mol5386
SMILES: NCC(=O)N(C(=O)CN)C(C(=O)O)(C(=O)CN)C(=O)CN
InChI: InChI=1S/C10H17N5O6/c11-1-5(16)10(9(20)21,6(17)2-12)15(7(18)3-13)8(19)4-14/h1-4,11-14H2,(H,20,21)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.05 | IUPAC digitized pKa | 4 » 3 |
| 3.10 | IUPAC digitized pKa | 4 » 3 |
| 7.70 | IUPAC digitized pKa | 0 » -1 |
| 8.02 | IUPAC digitized pKa | 0 » -1 |