| Keyword(s): | Human Metabolites |
| Molecule Category | Salt-form |
| UNII | 8K6TNK3HQ8 |
| EPA CompTox | DTXSID30961413 |
Structure
| InChI Key | ADODRSVGNHNKAT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H7ClN2 |
| Molecular Weight | 178.01 |
| AlogP | 2.05 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 38.05 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 41052-75-9 |
| NORMAN SUSDAT | |
| FDA SRS | 8K6TNK3HQ8 |
| PubChem | 418422 |
CONTENTS
