| Trade Names: | |
| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| ATC: | V08AD03 |
| UNII: | 5NPJ6BPX36 |
Structure
| InChI Key | ROSXARVHJNYYDO-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H11I2NO3 |
| Molecular Weight | 447.01 |
| AlogP | 2.01 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 48.3 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 587-61-1 |
| ChEBI | 32064 |
| ChEMBL | CHEMBL1200821 |
| DrugBank | DB09366 |
| DrugCentral | 2306 |
| EPA CompTox | DTXSID6023527 |
| FDA SRS | 5NPJ6BPX36 |
| PubChem | 4949 |
| SureChEMBL | SCHEMBL38586 |
| ZINC | ZINC000003831392 |
CONTENTS