| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3TVU9I8QR1 |
| EPA CompTox | DTXSID5028114 |
Structure
| InChI Key | XLAYCZJJQWGFAZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H14N2 |
| Molecular Weight | 174.12 |
| AlogP | 2.34 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 27.03 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 63133-74-4 |
| NORMAN SUSDAT | |
| FDA SRS | 3TVU9I8QR1 |
| PubChem | 113027 |
| ChemSpider | 101304.0 |
CONTENTS
