Compound Detail
CHEMBL2164342
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Basic Information
| ChEMBL ID | CHEMBL2164342 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CYYDDFDTTQSUPE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
298.4
MW (Da)
2.78
ALogP
4
HBA
1
HBD
33.7
PSA (Ų)
0.94
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.02
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 CHEMBL3155 | Ki | 7.02 | 7.02 | 96.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 7 | Ki | = | 96.0 | nM | 7.02 | Displacement of [3H]-5-CT from human cloned 5HT7 receptor | 22738316 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22738316 | 10.1021/jm3003679 | 5-hydroxytryptamine receptor 7 | 1 |
| 22738316 | 10.1021/jm3003679 | 5-hydroxytryptamine receptor 1A | 1 |
| 22738316 | 10.1021/jm3003679 | Adrenergic receptor alpha-1 | 1 |
Data from ChEMBL 36 via Core Engine