Compound Detail
CHEMBL5193472
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Basic Information
| ChEMBL ID | CHEMBL5193472 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MSQRWTZUUURCRC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
331.4
MW (Da)
2.56
ALogP
4
HBA
3
HBD
100.5
PSA (Ų)
0.53
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| G-protein coupled receptor 39 CHEMBL3091266 | EC50 | 6.6 | 6.6 | 251.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| G-protein coupled receptor 39 | EC50 | = | 251.0 | nM | 6.6 | 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 | 3 |
Data from ChEMBL 36 via Core Engine