| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 734ESH36S2 |
| EPA CompTox | DTXSID8042183 |
Structure
| InChI Key | XKUWFOYPQIVFMM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H13Cl2N3O4 |
| Molecular Weight | 321.03 |
| AlogP | 3.1 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 89.52 |
| Heavy Atoms | 20.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 26389-78-6 |
| NORMAN SUSDAT | |
| FDA SRS | 734ESH36S2 |
CONTENTS
