| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | VL6H50RQF4 |
| EPA CompTox | DTXSID1062910 |
Structure
| InChI Key | RHRVANRKEISTIR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H14N4 |
| Molecular Weight | 166.12 |
| AlogP | -0.01 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 71.64 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 3217-00-3 |
| NORMAN SUSDAT | |
| FDA SRS | VL6H50RQF4 |
| PubChem | 76685 |
| ChemSpider | 69146.0 |
CONTENTS
