| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | E57G47M2RW |
| EPA CompTox | DTXSID4068167 |
Structure
| InChI Key | GFHPSQFCHUIFTO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H5Cl1N2 |
| Molecular Weight | 128.01 |
| AlogP | 1.22 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 25.78 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 39204-47-2 |
| NORMAN SUSDAT | |
| FDA SRS | E57G47M2RW |
| PubChem | 170169 |
| ChemSpider | 148793.0 |
CONTENTS
