Compound Detail
CHEMBL334583
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Basic Information
| ChEMBL ID | CHEMBL334583 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XJSXFNHFIBCTDU-HZLVTQRSSA-N |
2
Targets
3
Activities
2
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
172.1
MW (Da)
-1.91
ALogP
4
HBA
3
HBD
87.7
PSA (Ų)
0.43
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.1
EC50 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, kainate CHEMBL2094119 | IC50 | 5.1 | 5.1 | 7900.0 | 1 |
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | IC50 | 4.37 | 4.37 | 42600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, kainate | IC50 | = | 7900.0 | nM | 5.1 | Binding affinity against Ionotropic glutamate receptor kainate using [3H]KAIN as... | 10514280 |
| Glutamate receptor ionotropic, AMPA | IC50 | = | 42600.0 | nM | 4.37 | Binding affinity against Ionotropic glutamate receptor AMPA using [3H]AMPA as ra... | 10514280 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10514280 | 10.1021/jm991081g | Mus musculus | 2 |
| 10514280 | 10.1021/jm991081g | Glutamate receptor ionotropic, AMPA | 1 |
| 10514280 | 10.1021/jm991081g | Glutamate receptor ionotropic, kainate | 1 |
| 10514280 | 10.1021/jm991081g | Glutamate NMDA receptor | 1 |
| 10514280 | 10.1021/jm991081g | Rattus norvegicus | 1 |
| 10514280 | 10.1021/jm991081g | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine