Compound Detail
CHEMBL5885905
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Basic Information
| ChEMBL ID | CHEMBL5885905 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LGQCQDSBCNBWRK-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
438.5
MW (Da)
4.42
ALogP
7
HBA
0
HBD
79.9
PSA (Ų)
0.46
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Calmodulin-domain protein kinase 1 CHEMBL1781862 | IC50 | 8.46 | 8.46 | 3.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Calmodulin-domain protein kinase 1 | IC50 | = | 3.5 | nM | 8.46 | Enzymatic Inhibition Assay: Inhibitors were evaluated in triplicate in eight-poi... | - |
Data from ChEMBL 36 via Core Engine