Compound Detail
CHEMBL110929
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL110929 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WOAYPTAVBXESLH-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
385.8
MW (Da)
2.42
ALogP
9
HBA
1
HBD
111.6
PSA (Ų)
0.42
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.72
IC50 1 meas. best 4.06
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | Ki | 5.72 | 5.72 | 1900.0 | 1 |
| Glutamate NMDA receptor CHEMBL1907608 | Ki | 4.72 | 4.72 | 19000.0 | 1 |
| Glutamate receptor ionotropic, kainate CHEMBL2094119 | IC50 | 4.06 | 4.06 | 88000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA | Ki | = | 1900.0 | nM | 5.72 | Binding affinity at ionotropic glutamate receptor AMPA in rat cortical membranes... | 11543685 |
| Glutamate NMDA receptor | Ki | = | 19000.0 | nM | 4.72 | Ability to displace [3H]glycine from NMDA receptor in rat cortical membranes | 11543685 |
| Glutamate receptor ionotropic, kainate | IC50 | = | 88000.0 | nM | 4.06 | Inhibition of [3H]KA binding to kainate receptor of rat brain membranes | 11543685 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11543685 | 10.1021/jm010862q | Glutamate receptor ionotropic, AMPA | 1 |
| 11543685 | 10.1021/jm010862q | Glutamate NMDA receptor | 1 |
| 11543685 | 10.1021/jm010862q | Glutamate receptor ionotropic, kainate | 1 |
Data from ChEMBL 36 via Core Engine