Compound Detail
CHEMBL329046
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Basic Information
| ChEMBL ID | CHEMBL329046 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RLXHAWJOGOMQQU-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
348.5
MW (Da)
4.68
ALogP
3
HBA
0
HBD
17.4
PSA (Ų)
0.67
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.87
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 6 CHEMBL3371 | Ki | 6.87 | 6.87 | 136.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 6 | Ki | = | 136.0 | nM | 6.87 | Binding affinity towards human 5-hydroxytryptamine 6 receptor | 12825922 |
| 5-hydroxytryptamine receptor 6 | Ki | = | 136.0 | nM | 6.87 | Ability to displace [3H]LSD from human 5-hydroxytryptamine 6 receptor transientl... | 15050637 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12825922 | 10.1021/jm030030n | 5-hydroxytryptamine receptor 6 | 1 |
| 15050637 | 10.1016/j.bmcl.2004.01.071 | 5-hydroxytryptamine receptor 6 | 1 |
Data from ChEMBL 36 via Core Engine