Compound Detail
CHEMBL49907
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Basic Information
| ChEMBL ID | CHEMBL49907 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZNKRXWOIWMDTAD-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
282.8
MW (Da)
3.37
ALogP
3
HBA
1
HBD
41.6
PSA (Ų)
0.92
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.14
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 CHEMBL4317 | Ki | 6.14 | 6.14 | 728.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 4 | Ki | = | 728.0 | nM | 6.14 | Binding affinity at 5-hydroxytryptamine 4 receptor in rat striatal membranes by ... | 9171886 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9171886 | 10.1021/jm960853v | 5-hydroxytryptamine receptor 4 | 1 |
Data from ChEMBL 36 via Core Engine