Compound Detail
CHEMBL5572680
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Basic Information
| ChEMBL ID | CHEMBL5572680 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HVQJGXLUPRDZGP-GFCCVEGCSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
329.4
MW (Da)
3.00
ALogP
5
HBA
3
HBD
96.7
PSA (Ų)
0.67
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Citron Rho-interacting kinase CHEMBL5579 | IC50 | 7.04 | 7.04 | 92.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Citron Rho-interacting kinase | IC50 | = | 92.0 | nM | 7.04 | Inhibition of human recombinant CITK kinase domain assessed as phosphorylation o... | 38330278 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38330278 | 10.1021/acs.jmedchem.3c01807 | Citron Rho-interacting kinase | 1 |
Data from ChEMBL 36 via Core Engine