Compound Detail
CHEMBL5415012
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Basic Information
| ChEMBL ID | CHEMBL5415012 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HNOBTZZRTZSQTJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
401.9
MW (Da)
5.19
ALogP
5
HBA
2
HBD
79.8
PSA (Ų)
0.48
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 9.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 9.05 | 9.05 | 0.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta | IC50 | = | 0.9 | nM | 9.05 | Displacement of FL-KRREILSRRP[ps]ERYR-NH2 from human recombinant N-terminal His6... | 37235865 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37235865 | 10.1021/acs.jmedchem.3c00364 | Glycogen synthase kinase-3 beta | 1 |
Data from ChEMBL 36 via Core Engine