Compound Detail
CHEMBL4776391
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Basic Information
| ChEMBL ID | CHEMBL4776391 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UJFGQFJVAPMCHZ-XYOKQWHBSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
310.3
MW (Da)
2.65
ALogP
5
HBA
3
HBD
102.6
PSA (Ų)
0.46
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Casein kinase II subunit alpha CHEMBL3629 | IC50 | 6.48 | 6.48 | 330.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Casein kinase II subunit alpha | IC50 | = | 330.0 | nM | 6.48 | Inhibition of recombinant human CK2alpha (1 to 336 residues) expressed in Escher... | 32283296 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32283296 | 10.1016/j.ejmech.2020.112267 | Casein kinase II subunit alpha | 1 |
Data from ChEMBL 36 via Core Engine