| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | M3V5GU3YNN |
| EPA CompTox | DTXSID20206224 |
Structure
| InChI Key | JYHSJQNYYLGMEI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H9N1O2 |
| Molecular Weight | 115.06 |
| AlogP | 0.52 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 42.25 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 57597-62-3 |
| NORMAN SUSDAT | |
| FDA SRS | M3V5GU3YNN |
| PubChem | 93731 |
| ChemSpider | 72008.0 |
CONTENTS
