Molecule ID: mol13713
SMILES: N#CCCNC(CC(N)=O)C(=O)O
InChI: InChI=1S/C7H11N3O3/c8-2-1-3-10-5(7(12)13)4-6(9)11/h5,10H,1,3-4H2,(H2,9,11)(H,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.46 | Datawarrior | 0 » -1 |
| 6.46 | OCHEM | 0 » -1 |
| 6.46 | QSARToolbox | 0 » -1 |