| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID7068051 |
| InChI Key | CXNNRNMUZUHBDI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C17H11N1O1 |
| Molecular Weight | 245.08 |
| AlogP | 4.47 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 36.93 |
| Heavy Atoms | 19.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 37780-79-3 |
| NORMAN SUSDAT | |
| PubChem | 169964 |
| ChemSpider | 21230105.0 |