| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| UNII | 35MRW7B4AD |
| EPA CompTox | DTXSID4048438 |
Structure
| InChI Key | PDWUPXJEEYOOTR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H10IN3 |
| Molecular Weight | 275.09 |
| AlogP | 1.27 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 61.9 |
| Molecular species | BASE |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 92769 |
| ChEMBL | CHEMBL818 |
| DrugBank | DB06704 |
| FDA SRS | 35MRW7B4AD |
| SureChEMBL | SCHEMBL140591 |
| ZINC | ZINC000001538318 |
CONTENTS
