| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | JJV56A2CNJ |
| EPA CompTox | DTXSID8052011 |
Structure
| InChI Key | QKJPXROEIJPNHG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H15N1 |
| Molecular Weight | 173.12 |
| AlogP | 3.05 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3288-99-1 |
| NORMAN SUSDAT | |
| FDA SRS | JJV56A2CNJ |
| PubChem | 76784 |
| ChemSpider | 69240.0 |
CONTENTS
