| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | WI5L987JR2 |
| EPA CompTox | DTXSID7058915 |
Structure
| InChI Key | XLEMRIJDZGESRG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H17N1 |
| Molecular Weight | 199.14 |
| AlogP | 3.69 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 3.24 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 84-95-7 |
| NORMAN SUSDAT | |
| FDA SRS | WI5L987JR2 |
| PubChem | 66547 |
| ChemSpider | 59918.0 |
CONTENTS
