| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7UD8ZK82XC |
| EPA CompTox | DTXSID80222546 |
Structure
| InChI Key | PAZCLCHJOWLTGA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H7N1O2 |
| Molecular Weight | 185.05 |
| AlogP | 0.92 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 37.38 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 7223-50-9 |
| NORMAN SUSDAT | |
| FDA SRS | 7UD8ZK82XC |
| PubChem | 81644 |
| ChemSpider | 73669.0 |
CONTENTS
