| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6GF9B456WW |
| EPA CompTox | DTXSID5059030 |
Structure
| InChI Key | ISGXOWLMGOPVPB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C20H19N1 |
| Molecular Weight | 273.15 |
| AlogP | 4.89 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 3.24 |
| Heavy Atoms | 21.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 91-73-6 |
| NORMAN SUSDAT | |
| FDA SRS | 6GF9B456WW |
| PubChem | 66681 |
| ChemSpider | 60047.0 |
CONTENTS
