Compound Detail
CHEMBL322440
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Basic Information
| ChEMBL ID | CHEMBL322440 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PVZSTMAADXQOKS-UHFFFAOYSA-N |
3
Targets
4
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
331.7
MW (Da)
0.92
ALogP
9
HBA
2
HBD
131.3
PSA (Ų)
0.55
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.92
Ki 1 meas. best 5.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | Ki | 5.43 | 5.43 | 3700.0 | 1 |
| Glutamate receptor ionotropic, AMPA CHEMBL2096617 | IC50 | 4.92 | 4.92 | 12000.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 4.32 | 4.32 | 48000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA | Ki | = | 3700.0 | nM | 5.43 | Binding affinity at ionotropic glutamate receptor AMPA in rat cortical membranes... | 11543685 |
| Glutamate receptor ionotropic, AMPA | IC50 | = | 12000.0 | nM | 4.92 | Antagonism at ionotropic glutamate receptor AMPA in mouse cortical wedge prepara... | 11543685 |
| Unchecked | IC50 | = | 48000.0 | nM | 4.32 | Inhibition of specific binding of [3H]KA at 100 uM concentration against iGluRs | 11543685 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11543685 | 10.1021/jm010862q | Glutamate receptor ionotropic, AMPA | 2 |
| 11543685 | 10.1021/jm010862q | Glutamate NMDA receptor | 2 |
| 11543685 | 10.1021/jm010862q | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine