| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | EW62LG5TQ7 |
| EPA CompTox | DTXSID5051571 |
Structure
| InChI Key | OQURWGJAWSLGQG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H7N1O1 |
| Molecular Weight | 85.05 |
| AlogP | 0.73 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 29.43 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 110-78-1 |
| NORMAN SUSDAT | |
| FDA SRS | EW62LG5TQ7 |
| PubChem | 61033 |
| ChemSpider | 54992.0 |
CONTENTS
