| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
Structure
| InChI Key | JGVSFNXTWYOUFV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H8F3N1O1 |
| Molecular Weight | 191.06 |
| AlogP | 2.15 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 33.12 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1228631-54-6 |
| NORMAN SUSDAT |
CONTENTS
