Compound Detail
CHEMBL304498
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Basic Information
| ChEMBL ID | CHEMBL304498 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WBUWEGQYMKGXAI-ZIAGYGMSSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
289.4
MW (Da)
3.61
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.80
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.19
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2A CHEMBL322 | Ki | 6.19 | 6.19 | 644.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2A | Ki | = | 644.0 | nM | 6.19 | Affinity at [3H]ketanserin-labeled 5-hydroxytryptamine 2A receptor in rat brain ... | 9622555 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9622555 | 10.1021/jm980076u | 5-hydroxytryptamine receptor 2A | 1 |
| 9622555 | 10.1021/jm980076u | 5-hydroxytryptamine receptor 1A | 1 |
Data from ChEMBL 36 via Core Engine