Compound Detail
CHEMBL2181185
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL2181185 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DBUWXKOGBDPUGP-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
352.4
MW (Da)
5.03
ALogP
3
HBA
0
HBD
25.4
PSA (Ų)
0.60
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 CHEMBL1875 | Ki | 7.48 | 7.48 | 33.0 | 1 |
| 5-hydroxytryptamine receptor 4 CHEMBL5017 | Ki | 7.0 | 7.0 | 101.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 | Ki | = | 33.0 | nM | 7.48 | Displacement of [3H]GR113808 from human recombinant 5HT4R expressed in HEK293T c... | 23102207 |
| 5-hydroxytryptamine receptor 4 | Ki | = | 101.0 | nM | 7.0 | 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