| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2APY7DEB6E |
| EPA CompTox | DTXSID70186305 |
Structure
| InChI Key | VKJXAQYPOTYDLO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H13N1 |
| Molecular Weight | 135.1 |
| AlogP | 1.5 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 26.02 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3261-62-9 |
| NORMAN SUSDAT | |
| FDA SRS | 2APY7DEB6E |
| PubChem | 76751 |
| ChemSpider | 69207.0 |
CONTENTS
