Compound Detail
CHEMBL2181181
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Basic Information
| ChEMBL ID | CHEMBL2181181 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UNTKPDCHLNXXQO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
364.5
MW (Da)
4.90
ALogP
4
HBA
0
HBD
34.6
PSA (Ų)
0.58
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 CHEMBL5017 | Ki | 6.63 | 6.63 | 233.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 | Ki | = | 233.0 | nM | 6.63 | Displacement of [3H]GR113808 from 5HT4R in guinea pig striatal membranes | 23102207 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23102207 | 10.1021/jm300943r | 5-hydroxytryptamine receptor 4 | 4 |
Data from ChEMBL 36 via Core Engine