Compound Detail
CHEMBL10339
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Basic Information
| ChEMBL ID | CHEMBL10339 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LQDSYQNNYIFHKU-UHFFFAOYSA-N |
4
Targets
5
Activities
2
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
228.2
MW (Da)
0.68
ALogP
5
HBA
3
HBD
109.6
PSA (Ų)
0.66
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.75
EC50 1 meas. best 4.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | IC50 | 6.75 | 6.225 | 180.0 | 2 |
| Unchecked CHEMBL612545 | IC50 | 6.2 | 6.2 | 630.0 | 1 |
| Glutamate receptor ionotropic, AMPA CHEMBL2096617 | IC50 | 5.75 | 5.75 | 1800.0 | 1 |
| Rattus norvegicus CHEMBL376 | EC50 | 4.43 | 4.43 | 37000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA | IC50 | = | 180.0 | nM | 6.75 | Concentration required for 50% inhibition of [3H]Glu binding to AMPA receptor in... | 1383544 |
| Unchecked | IC50 | = | 630.0 | nM | 6.2 | In vitro binding affinity against Metabotropic glutamate receptor using [3H](S)-... | 9526567 |
| Glutamate receptor ionotropic, AMPA | IC50 | = | 1800.0 | nM | 5.75 | Compound was tested for in vitro binding affinity against Ionotropic glutamate r... | 9526567 |
| Glutamate receptor ionotropic, AMPA | IC50 | = | 2000.0 | nM | 5.7 | Concentration required for 50% inhibition of [3H]AMPA binding to AMPA receptor i... | 1383544 |
| Rattus norvegicus | EC50 | = | 37000.0 | nM | 4.43 | Compound was tested for electrophysiological experiments using rat cortical wedg... | 9526567 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9526567 | 10.1021/jm9706731 | Mus musculus | 2 |
| 1383544 | 10.1021/jm00097a008 | Glutamate receptor ionotropic, AMPA | 2 |
| 1383544 | 10.1021/jm00097a008 | Glutamate NMDA receptor | 2 |
| 9526567 | 10.1021/jm9706731 | Glutamate receptor ionotropic, AMPA | 1 |
| 9526567 | 10.1021/jm9706731 | Unchecked | 1 |
| 9526567 | 10.1021/jm9706731 | Rattus norvegicus | 1 |
| 1383544 | 10.1021/jm00097a008 | Glutamate receptor ionotropic, kainate | 1 |
Data from ChEMBL 36 via Core Engine