| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | X408YTO5HA |
| EPA CompTox | DTXSID0060802 |
Structure
| InChI Key | QKYWADPCTHTJHQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H13N1 |
| Molecular Weight | 87.1 |
| AlogP | 0.86 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 12.03 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 625-43-4 |
| NORMAN SUSDAT | |
| FDA SRS | X408YTO5HA |
| PubChem | 12249 |
| ChemSpider | 11748.0 |
CONTENTS
