Compound Detail
CHEMBL5887826
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Basic Information
| ChEMBL ID | CHEMBL5887826 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IBRKDXNYRBZUGZ-OAQYLSRUSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
368.5
MW (Da)
4.92
ALogP
5
HBA
1
HBD
51.2
PSA (Ų)
0.84
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 alpha CHEMBL2850 | IC50 | 7.62 | 7.62 | 24.0 | 1 |
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 6.96 | 6.96 | 110.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen synthase kinase-3 alpha | IC50 | = | 24.0 | nM | 7.62 | Caliper Assay: A selection of compounds was screened against a selected panel of... | - |
| Glycogen synthase kinase-3 beta | IC50 | = | 110.0 | nM | 6.96 | Caliper Assay: A selection of compounds was screened against a selected panel of... | - |
Data from ChEMBL 36 via Core Engine