Compound Detail
CHEMBL5281961
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Basic Information
| ChEMBL ID | CHEMBL5281961 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WZJJOHJIKKADBA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
353.2
MW (Da)
4.15
ALogP
4
HBA
0
HBD
44.1
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Kir3.1/Kir3.4 CHEMBL3038488 | IC50 | 8.7 | 8.7 | 2.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Kir3.1/Kir3.4 | IC50 | = | 2.0 | nM | 8.7 | Inhibition of recombinant human GIRK1/4 channel | 36924945 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36924945 | 10.1016/j.bmcl.2023.129237 | Kir3.1/Kir3.4 | 1 |
| 36924945 | 10.1016/j.bmcl.2023.129237 | No relevant target | 1 |
| 36924945 | 10.1016/j.bmcl.2023.129237 | Unchecked | 1 |
| 36924945 | 10.1016/j.bmcl.2023.129237 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine