| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | MFF90009B9 |
| EPA CompTox | DTXSID10214292 |
Structure
| InChI Key | FOWABKOXWTZAKY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C15H9Cl2N5 |
| Molecular Weight | 329.02 |
| AlogP | 3.32 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 55.96 |
| Heavy Atoms | 22.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 64098-32-4 |
| NORMAN SUSDAT | |
| FDA SRS | MFF90009B9 |
| PubChem | 68832 |
| ChemSpider | 62065.0 |
CONTENTS
