| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 527U1WJJ18 |
| EPA CompTox | DTXSID6021905 |
Structure
| InChI Key | SJNALLRHIVGIBI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H5N1 |
| Molecular Weight | 67.04 |
| AlogP | 1.09 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 5.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 109-75-1 |
| NORMAN SUSDAT | |
| FDA SRS | 527U1WJJ18 |
| PubChem | 8009 |
| ChemSpider | 13876176.0 |
CONTENTS
