| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Y397TH9DAN |
| EPA CompTox | DTXSID10240076 |
Structure
| InChI Key | GEJOEGDFPKMVEQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H19N1O3 |
| Molecular Weight | 285.14 |
| AlogP | 5.07 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 52.37 |
| Heavy Atoms | 21.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 93980-93-9 |
| NORMAN SUSDAT | |
| FDA SRS | Y397TH9DAN |
| PubChem | 3023148 |
| ChemSpider | 2289440.0 |
CONTENTS
