| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | V8JL6C4DFL |
| EPA CompTox | DTXSID60196837 |
Structure
| InChI Key | JMVIVASFFKKFQK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H11N1O1 |
| Molecular Weight | 161.08 |
| AlogP | 1.81 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4641-57-0 |
| NORMAN SUSDAT | |
| FDA SRS | V8JL6C4DFL |
| PubChem | 78375 |
| ChemSpider | 70744.0 |
CONTENTS
