| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | EQF2794IRE |
| EPA CompTox | DTXSID2064995 |
Structure
| InChI Key | IGHBXJSNZCFXNK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H2Cl1N3O3 |
| Molecular Weight | 198.98 |
| AlogP | 1.78 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 82.06 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 10199-89-0 |
| NORMAN SUSDAT | |
| FDA SRS | EQF2794IRE |
| PubChem | 25043 |
| ChemSpider | 7088.0 |
CONTENTS
