| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | TN2938WK3L |
| EPA CompTox | DTXSID30176444 |
Structure
| InChI Key | OKFOGGVYBGIWSE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H20O1 |
| Molecular Weight | 240.15 |
| AlogP | 4.0 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 22004-65-5 |
| NORMAN SUSDAT | |
| FDA SRS | TN2938WK3L |
| PubChem | 89144 |
| ChemSpider | 80440.0 |
CONTENTS
