| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20170395 |
Structure
| InChI Key | XSRLHGSAMGVDJU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H13N1 |
| Molecular Weight | 159.1 |
| AlogP | 3.29 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 15.79 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 17790-93-1 |
| NORMAN SUSDAT | |
| PubChem | 87307 |
| ChemSpider | 78581.0 |
CONTENTS
