Molecule ID: mol4151
SMILES: CCOC(OCC)c1cc(O)ncn1
InChI: InChI=1S/C9H14N2O3/c1-3-13-9(14-4-2)7-5-8(12)11-6-10-7/h5-6,9H,3-4H2,1-2H3,(H,10,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.50 | IUPAC digitized pKa | 1 » 0 |
| 7.80 | IUPAC digitized pKa | 0 » -1 |