Compound Detail
CHEMBL52514
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Basic Information
| ChEMBL ID | CHEMBL52514 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AJGXZBAEOZHOEA-PSRSYCBASA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
173.2
MW (Da)
-0.18
ALogP
3
HBA
3
HBD
100.6
PSA (Ų)
0.51
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, kainate 1 CHEMBL1918 | Ki | 5.66 | 5.66 | 2200.0 | 1 |
| Glutamate receptor ionotropic, kainate 2 CHEMBL3683 | Ki | 5.6 | 5.6 | 2500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, kainate 1 | Ki | = | 2200.0 | nM | 5.66 | Binding affinity of compound was determined against Ionotropic glutamate recepto... | 10969973 |
| Glutamate receptor ionotropic, kainate 2 | Ki | = | 2500.0 | nM | 5.6 | Binding affinity of compound was determined against Ionotropic glutamate recepto... | 10969973 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10969973 | 10.1016/s0960-894x(00)00346-2 | Glutamate receptor ionotropic, kainate 1 | 1 |
| 10969973 | 10.1016/s0960-894x(00)00346-2 | Glutamate receptor ionotropic, kainate 2 | 1 |
| 10969973 | 10.1016/s0960-894x(00)00346-2 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine