Compound Detail
CHEMBL122818
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Basic Information
| ChEMBL ID | CHEMBL122818 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MKJUSWFBSFKEPH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
385.9
MW (Da)
1.86
ALogP
7
HBA
1
HBD
94.3
PSA (Ų)
0.59
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.64
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 CHEMBL1875 | Ki | 7.64 | 7.64 | 23.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 | Ki | = | 23.0 | nM | 7.64 | Binding affinity was determined against cloned 5-hydroxytryptamine 4E receptor i... | 11020291 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11020291 | 10.1021/jm0009538 | 5-hydroxytryptamine receptor 4 | 1 |
Data from ChEMBL 36 via Core Engine