| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | FK3B32KF2J |
| EPA CompTox | DTXSID90225942 |
| InChI Key | LPCWDVLDJVZIHA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H9N1 |
| Molecular Weight | 167.07 |
| AlogP | 2.91 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 7498-57-9 |
| NORMAN SUSDAT | |
| FDA SRS | FK3B32KF2J |
| PubChem | 82008 |
| ChemSpider | 8277.0 |