Compound Detail
CHEMBL5170821
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Basic Information
| ChEMBL ID | CHEMBL5170821 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SCEFCHMRVURBBT-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
355.4
MW (Da)
4.09
ALogP
5
HBA
0
HBD
46.3
PSA (Ų)
0.56
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G-protein coupled receptor 39 CHEMBL3091266 | EC50 | 6.85 | 6.705 | 142.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G-protein coupled receptor 39 | EC50 | = | 142.0 | nM | 6.85 | Positive allosteric activity at human GPR39 receptor expressed in CHO cells asse... | 35123006 |
| G-protein coupled receptor 39 | EC50 | = | 273.0 | nM | 6.56 | Positive allosteric activity at human GPR39 receptor expressed in CHO cells asse... | 35123006 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35123006 | 10.1016/j.bmcl.2022.128607 | G-protein coupled receptor 39 | 6 |
Data from ChEMBL 36 via Core Engine