Compound Detail
CHEMBL1945778
IOFLUPANE 💊 Approved Drug
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💊 Approved Drug
Basic Information
| ChEMBL ID | CHEMBL1945778 |
| Name | IOFLUPANE |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | HXWLAJVUJSVENX-HZMVEIRTSA-N |
| Therapeutic | ✓ Yes |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
5
Known Names
Molecular Properties
431.3
MW (Da)
3.76
ALogP
3
HBA
0
HBD
29.5
PSA (Ų)
0.53
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| First Approval | 2000 |
| Availability | Prescription |
| Chirality | Single Enantiomer |
Activity Summary
Ki 1 meas. best 7.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sodium-dependent dopamine transporter CHEMBL238 | Ki | 7.55 | 7.55 | 28.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sodium-dependent dopamine transporter | Ki | = | 28.18 | nM | 7.55 | Displacement of [3H]WIN35428 from human cloned DAT receptor expressed in human H... | 22300887 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22300887 | 10.1016/j.bmc.2012.01.014 | Sodium-dependent dopamine transporter | 1 |
| - | 10.6019/CHEMBL3301361 | No relevant target | 1 |
| - | 10.6019/CHEMBL3301361 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine