Compound Detail
CHEMBL486569
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Basic Information
| ChEMBL ID | CHEMBL486569 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CERLGXAGGNYXLC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
271.7
MW (Da)
3.47
ALogP
2
HBA
2
HBD
57.8
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 5 CHEMBL1641352 | IC50 | 4.6 | 4.6 | 25000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 5 | IC50 | = | 25000.0 | nM | 4.6 | Positive allosteric modulator activity at mGluR5 in mouse BV2 cells assessed as ... | 25801156 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18998663 | 10.1021/jm800809f | Small conductance calcium-activated potassium channel protein 3 | 1 |
| 25801156 | 10.1016/j.bmc.2015.02.054 | Unchecked | 1 |
| 25801156 | 10.1016/j.bmc.2015.02.054 | ADMET | 1 |
| 25801156 | 10.1016/j.bmc.2015.02.054 | Metabotropic glutamate receptor 5 | 1 |
Data from ChEMBL 36 via Core Engine