| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 15E9I74NZ8 |
| EPA CompTox | DTXSID8057643 |
Structure
| InChI Key | YLRNESBGEGGQBK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C22H33N1O3 |
| Molecular Weight | 359.25 |
| AlogP | 4.82 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 38.77 |
| Heavy Atoms | 26.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 139-62-8 |
| NORMAN SUSDAT | |
| FDA SRS | 15E9I74NZ8 |
| PubChem | 10839 |
| ChemSpider | 10382.0 |
CONTENTS
