Molecule ID: mol1491
SMILES: CC[C@@H](C)C(=O)O
InChI: InChI=1S/C5H10O2/c1-3-4(2)5(6)7/h4H,3H2,1-2H3,(H,6,7)/t4-/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.76 | OCHEM | 0 » -1 |
| 4.76 | OCHEM | 0 » -1 |
| 4.81 | OCHEM | 0 » -1 |
| 4.81 | OCHEM | 0 » -1 |
| 4.81 | Hunt | 0 » -1 |
| 4.81 | OCHEM | 0 » -1 |
| 4.81 | OCHEM | 0 » -1 |
| 4.81 | OCHEM | 0 » -1 |