| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID90887327 |
Structure
| InChI Key | VLLYHFSAJNIONB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C20H1F39O2 |
| Molecular Weight | 1013.94 |
| AlogP | 12.07 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 18.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 61.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 68310-12-3 |
| NORMAN SUSDAT | |
| PubChem | 3017844 |
| ChemSpider | 2285495.0 |
CONTENTS
