| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | G68P3TM39D |
| EPA CompTox | DTXSID00181383 |
Structure
| InChI Key | DURRSEGFTCZKMK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H11N1O1 |
| Molecular Weight | 125.08 |
| AlogP | 0.79 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2687-97-0 |
| NORMAN SUSDAT | |
| FDA SRS | G68P3TM39D |
| PubChem | 75897 |
| ChemSpider | 68402.0 |
CONTENTS
