Molecule ID: mol19439
SMILES: O=C(O)[C@@H]1CCNC[C@@H]1O
InChI: InChI=1S/C6H11NO3/c8-5-3-7-2-1-4(5)6(9)10/h4-5,7-8H,1-3H2,(H,9,10)/t4-,5+/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.70 | Baltruschat ChEMBL | 1 » 0 |
| 10.00 | Baltruschat ChEMBL | 0 » -1 |