| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7YLQ9Y83PN |
| EPA CompTox | DTXSID6057956 |
Structure
| InChI Key | IUFUITYPUYMIHI-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H24F1N5O1 |
| Molecular Weight | 333.2 |
| AlogP | 2.41 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 89.91 |
| Heavy Atoms | 24.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 131475-57-5 |
| NORMAN SUSDAT | |
| FDA SRS | 7YLQ9Y83PN |
| ChemSpider | 9122813.0 |
CONTENTS
