Compound Detail
CHEMBL4443718
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Basic Information
| ChEMBL ID | CHEMBL4443718 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NUGDGCWFUWPHAC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
417.5
MW (Da)
3.49
ALogP
8
HBA
2
HBD
156.6
PSA (Ų)
0.22
QED
0
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Casein kinase II subunit alpha CHEMBL3629 | Ki | 6.66 | 6.66 | 220.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Casein kinase II subunit alpha | Ki | = | 220.0 | nM | 6.66 | Inhibition of CK2alpha (unknown origin) | 31400711 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31400711 | 10.1016/j.ejmech.2019.111581 | Casein kinase II subunit alpha | 1 |
Data from ChEMBL 36 via Core Engine