| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID70937137 |
Structure
| InChI Key | ZGILLTVEEBNDOB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H4ClN2O2 |
| Molecular Weight | 181.99 |
| AlogP | 2.12 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 66.93 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 16588-02-6 |
| NORMAN SUSDAT | |
| PubChem | 85504 |
CONTENTS
