| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Z4ZG7O5SZ9 |
| EPA CompTox | DTXSID3025910 |
Structure
| InChI Key | HJRJRUMKQCMYDL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H2Cl1N3O6 |
| Molecular Weight | 246.96 |
| AlogP | 2.06 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 129.42 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 88-88-0 |
| NORMAN SUSDAT | |
| FDA SRS | Z4ZG7O5SZ9 |
| PubChem | 6953 |
| ChemSpider | 6687.0 |
CONTENTS
