| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID7072882 |
| InChI Key | YAVXXWFSPXTPCW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C20H23Br1N4O6 |
| Molecular Weight | 494.08 |
| AlogP | 4.05 |
| Hydrogen Bond Acceptor | 9.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 10.0 |
| Polar Surface Area | 137.86 |
| Heavy Atoms | 31.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 82760-43-8 |
| NORMAN SUSDAT | |
| PubChem | 150016 |
| ChemSpider | 132241.0 |