Compound Detail
CHEMBL294781
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Basic Information
| ChEMBL ID | CHEMBL294781 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NGLULEGEHSXPSN-UHFFFAOYSA-N |
1
Targets
3
Activities
2
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
324.3
MW (Da)
2.24
ALogP
8
HBA
1
HBD
111.4
PSA (Ų)
0.46
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.7
Ki 1 meas. best 7.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | IC50 | 7.7 | 7.7 | 20.0 | 2 |
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | Ki | 7.7 | 7.7 | 20.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA | IC50 | = | 20.0 | nM | 7.7 | Binding affinity was determined against ionotropic glutamate receptor AMPA in ra... | 7562904 |
| Glutamate receptor ionotropic, AMPA | IC50 | = | 20.0 | nM | 7.7 | Binding affinity was determined against ionotropic glutamate receptor AMPA in ra... | 7562904 |
| Glutamate receptor ionotropic, AMPA | Ki | = | 20.0 | nM | 7.7 | Inhibition of [3H]AMPA binding to Ionotropic glutamate receptor from rat whole b... | 9207947 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9207947 | 10.1021/jm960664c | Glutamate NMDA receptor | 2 |
| 7562904 | 10.1021/jm00019a003 | Glutamate receptor ionotropic, AMPA | 2 |
| 9207947 | 10.1021/jm960664c | Glutamate receptor ionotropic, AMPA | 1 |
| 9207947 | 10.1021/jm960664c | Rattus norvegicus | 1 |
Data from ChEMBL 36 via Core Engine