| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID50988788 |
Structure
| InChI Key | CKOJGMKAXXTOLV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H9ClN4O |
| Molecular Weight | 176.05 |
| AlogP | -0.3 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 52.71 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 69049-03-2 |
| NORMAN SUSDAT | |
| PubChem | 3017906 |
CONTENTS
