| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 62QGS7CPS6 |
| EPA CompTox | DTXSID3074288 |
Structure
| InChI Key | RDOWQLZANAYVLL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H9N1 |
| Molecular Weight | 179.07 |
| AlogP | 3.39 |
| Hydrogen Bond Acceptor | 1.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 229-87-8 |
| NORMAN SUSDAT | |
| FDA SRS | 62QGS7CPS6 |
| PubChem | 9189 |
| ChemSpider | 8834.0 |
CONTENTS
