| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 5W43E2LG8X |
| EPA CompTox | DTXSID4062565 |
Structure
| InChI Key | LZMONXBJUOXABQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6Cl3N3O6 |
| Molecular Weight | 314.89 |
| AlogP | 3.37 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 129.42 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2631-68-7 |
| NORMAN SUSDAT | |
| FDA SRS | 5W43E2LG8X |
| PubChem | 17518 |
| ChemSpider | 16565.0 |
CONTENTS
