| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | A7PJG8E4XS |
| EPA CompTox | DTXSID70176448 |
Structure
| InChI Key | AUXIEQKHXAYAHG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H15N1 |
| Molecular Weight | 185.12 |
| AlogP | 3.41 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2201-23-2 |
| NORMAN SUSDAT | |
| FDA SRS | A7PJG8E4XS |
| PubChem | 75148 |
| ChemSpider | 67696.0 |
CONTENTS
