Compound Detail
CHEMBL292921
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Basic Information
| ChEMBL ID | CHEMBL292921 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QVWFRPYLSDUCFB-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
258.4
MW (Da)
3.20
ALogP
2
HBA
1
HBD
28.3
PSA (Ų)
0.91
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2A CHEMBL224 | Ki | 6.8 | 6.72 | 160.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2A | Ki | = | 160.0 | nM | 6.8 | Affinity against 5-hydroxytryptamine 2A receptor (K) labeled with [3H]ketanserin... | 8027974 |
| 5-hydroxytryptamine receptor 2A | Ki | = | 230.0 | nM | 6.64 | Affinity against 5-hydroxytryptamine 2A receptor (D) labeled with [125I]DOI. | 8027974 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8027974 | 10.1021/jm00039a004 | 5-hydroxytryptamine receptor 2C | 2 |
| 8027974 | 10.1021/jm00039a004 | 5-hydroxytryptamine receptor 2A | 2 |
| 8027974 | 10.1021/jm00039a004 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine