Compound Detail
CHEMBL302969
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Basic Information
| ChEMBL ID | CHEMBL302969 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VLVPOEGJBANBDN-ZMOGYAJESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
359.4
MW (Da)
3.06
ALogP
8
HBA
1
HBD
90.1
PSA (Ų)
0.44
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta CHEMBL262 | IC50 | 7.2 | 7.2 | 63.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen synthase kinase-3 beta | IC50 | = | 63.1 | nM | 7.2 | Ability to inhibit 50% glycogen synthase kinase-3 beta of recombinant human, exp... | 15080992 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15080992 | 10.1016/j.bmcl.2004.02.036 | Glycogen synthase kinase-3 beta | 1 |
Data from ChEMBL 36 via Core Engine