| Synonyms: | |
| Status: | Approved (1971) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
Structure
| InChI Key | VDNLFJGJEQUWRB-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C20H4Cl4I4O5 |
| Molecular Weight | 973.67 |
| AlogP | 9.0 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 87.74 |
| Molecular species | ACID |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 33.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
|
- | 29700 | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Melanoma | 3 | D008545 | ClinicalTrials |
| Melanoma | 3 | D008545 | ClinicalTrials |
| Tobacco Use Disorder | 3 | D014029 | ClinicalTrials |
| Psoriasis | 2 | D011565 | ClinicalTrials |
| Neuroendocrine Tumors | 1 | D018358 | ClinicalTrials |
| Breast Neoplasms | 1 | D001943 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 87202 |
| ChEMBL | CHEMBL1208422 |
| DrugBank | DB11182 |
| Human Metabolome Database | HMDB0036613 |
| Guide to Pharmacology | 2393 |
| SureChEMBL | SCHEMBL1464825 |
| ZINC | ZINC000150338646 |
CONTENTS