| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ZZE2Y51ZIZ |
| EPA CompTox | DTXSID1046213 |
Structure
| InChI Key | NGIFHAUKQGDVSR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C23H27N1O5 |
| Molecular Weight | 397.19 |
| AlogP | 5.12 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 59.04 |
| Heavy Atoms | 29.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 549-68-8 |
| NORMAN SUSDAT | |
| FDA SRS | ZZE2Y51ZIZ |
| PubChem | 68363 |
| ChemSpider | 61653.0 |
CONTENTS
