| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 44GGF9EW57 |
| EPA CompTox | DTXSID0051861 |
Structure
| InChI Key | DCWQZPJHHVLHSV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H9N1O1 |
| Molecular Weight | 99.07 |
| AlogP | 0.94 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 33.02 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2141-62-0 |
| NORMAN SUSDAT | |
| FDA SRS | 44GGF9EW57 |
| PubChem | 16501 |
| ChemSpider | 15643.0 |
CONTENTS
