| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | P9ZX68GA75 |
| EPA CompTox | DTXSID30235085 |
Structure
| InChI Key | MQBPAXAOMVELQG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9F15N3 |
| Molecular Weight | 434.99 |
| AlogP | 4.83 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 38.67 |
| Heavy Atoms | 27.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 858-46-8 |
| NORMAN SUSDAT | |
| FDA SRS | P9ZX68GA75 |
| PubChem | 70072 |
| ChemSpider | 63261.0 |
CONTENTS
