| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | A05OL9V6OM |
| EPA CompTox | DTXSID30171515 |
Structure
| InChI Key | HBJGQJWNMZDFKL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H4Cl1N5 |
| Molecular Weight | 169.02 |
| AlogP | 0.54 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 80.48 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1839-18-5 |
| NORMAN SUSDAT | |
| FDA SRS | A05OL9V6OM |
| PubChem | 94904 |
| ChemSpider | 85630.0 |
CONTENTS
