| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | VD6QK8C72H |
| EPA CompTox | DTXSID40164514 |
| InChI Key | YSZWJJANSNFQMM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H9N1O1 |
| Molecular Weight | 207.07 |
| AlogP | 2.79 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 40.86 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1503-49-7 |
| NORMAN SUSDAT | |
| FDA SRS | VD6QK8C72H |
| PubChem | 73921 |
| ChemSpider | 66553.0 |