Molecule ID: mol8539
SMILES: N=C(N)NOCCCC(=O)O
InChI: InChI=1S/C5H11N3O3/c6-5(7)8-11-3-1-2-4(9)10/h1-3H2,(H,9,10)(H4,6,7,8)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.07 | IUPAC digitized pKa | 1 » 0 |
| 4.07 | AttenGpKa training set | 1 » 0 |
| 7.59 | IUPAC digitized pKa | 0 » -1 |
| 7.59 | AttenGpKa training set | 0 » -1 |