Molecule ID: mol19138
SMILES: CCCCCCCCCCCCCCCCCC(=O)OC[C@@H]1CC(F)P(=O)(O)O1
InChI: InChI=1S/C22H42FO5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(24)27-19-20-18-21(23)29(25,26)28-20/h20-21H,2-19H2,1H3,(H,25,26)/t20-,21?/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.60 | OCHEM | 0 » -1 |
| 5.60 | Baltruschat ChEMBL | 0 » -1 |