| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | HD3UZX22D4 |
| EPA CompTox | DTXSID40188659 |
Structure
| InChI Key | HQFYIDOMCULPIW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H7N1 |
| Molecular Weight | 69.06 |
| AlogP | -0.16 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 12.03 |
| Heavy Atoms | 5.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 35161-71-8 |
| NORMAN SUSDAT | |
| FDA SRS | HD3UZX22D4 |
| PubChem | 96160 |
| ChemSpider | 86803.0 |
CONTENTS
