Compound Detail
CHEMBL85688
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Basic Information
| ChEMBL ID | CHEMBL85688 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SHYSPQUXUHGBAK-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
238.2
MW (Da)
0.59
ALogP
6
HBA
3
HBD
122.7
PSA (Ų)
0.71
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.77
IC50 1 meas. best 6.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | IC50 | 6.82 | 6.82 | 150.0 | 1 |
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | EC50 | 5.77 | 5.77 | 1700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA | IC50 | = | 150.0 | nM | 6.82 | Ability to inhibit the binding of [3H]AMPA radioligand to Ionotropic glutamate r... | 9651156 |
| Glutamate receptor ionotropic, AMPA | EC50 | = | 1700.0 | nM | 5.77 | Agonist effect for Ionotropic glutamate receptor AMPA was determined from in vit... | 9651156 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9651156 | 10.1021/jm9801206 | Glutamate receptor ionotropic, AMPA | 2 |
| 9651156 | 10.1021/jm9801206 | Glutamate receptor ionotropic, kainate | 1 |
| 9651156 | 10.1021/jm9801206 | Glutamate NMDA receptor | 1 |
Data from ChEMBL 36 via Core Engine