| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | D7ID553901 |
| EPA CompTox | DTXSID00939982 |
| InChI Key | AGNRWZQXNQBVQZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H5Cl3N2O2S1 |
| Molecular Weight | 309.91 |
| AlogP | 3.33 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 48.03 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1856-34-4 |
| NORMAN SUSDAT | |
| FDA SRS | D7ID553901 |