| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| InChI Key | ZIUMOXWDLICQQC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H6F13N1O2S1 |
| Molecular Weight | 426.99 |
| AlogP | 3.62 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 46.17 |
| Heavy Atoms | 25.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 87988-56-5 |
| NORMAN SUSDAT | |
| PubChem | 14661393 |