Compound Detail
CHEMBL336326
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Basic Information
| ChEMBL ID | CHEMBL336326 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | TVIKHTHPGBUJNY-LZCJLJQNSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
329.2
MW (Da)
2.79
ALogP
2
HBA
2
HBD
32.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.78
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 CHEMBL3602 | Ki | 8.78 | 8.78 | 1.7 | 1 |
| D(3) dopamine receptor CHEMBL234 | Ki | 7.52 | 7.52 | 30.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 | Ki | = | 1.68 | nM | 8.78 | tested for the inhibitory activity against sigma receptor rat cerebellar | 7990123 |
| D(3) dopamine receptor | Ki | = | 30.2 | nM | 7.52 | Tested for the inhibitory activity against Dopamine D3 receptor in infected Sf9 ... | 7990123 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7990123 | 10.1021/jm00050a021 | D(3) dopamine receptor | 1 |
| 7990123 | 10.1021/jm00050a021 | Sigma non-opioid intracellular receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine