| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Q37G40S4S8 |
| EPA CompTox | DTXSID2021105 |
Structure
| InChI Key | LKPLKUMXSAEKID-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6Cl5N1O2 |
| Molecular Weight | 292.84 |
| AlogP | 4.86 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 43.14 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 82-68-8 |
| NORMAN SUSDAT | |
| FDA SRS | Q37G40S4S8 |
| PubChem | 6720 |
| ChemSpider | 6464.0 |
CONTENTS
