| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID40880207 |
Structure
| InChI Key | DVGAKXCCCMYSPK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H6F24N4O2 |
| Molecular Weight | 718.01 |
| AlogP | 6.27 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 13.0 |
| Polar Surface Area | 117.22 |
| Heavy Atoms | 44.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5102-53-4 |
| NORMAN SUSDAT |
CONTENTS
