| Keyword(s): | Human Metabolites |
| Molecule Category | Salt-form |
| UNII | 3CCM9FCJ62 |
| EPA CompTox | DTXSID10195173 |
Structure
| InChI Key | GAEPVUMSCPGMFX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H8IN |
| Molecular Weight | 268.95 |
| AlogP | 2.17 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 26.02 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 42365-45-7 |
| NORMAN SUSDAT | |
| FDA SRS | 3CCM9FCJ62 |
| PubChem | 3016347 |
CONTENTS
