Compound Detail
CHEMBL302611
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Basic Information
| ChEMBL ID | CHEMBL302611 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ITJAESMDLSSBAU-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
234.2
MW (Da)
1.55
ALogP
5
HBA
2
HBD
113.6
PSA (Ų)
0.60
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, kainate CHEMBL2094119 | IC50 | 5.89 | 5.89 | 1300.0 | 1 |
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 5.19 | 5.19 | 6500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, kainate | IC50 | = | 1300.0 | nM | 5.89 | Antagonistic activity against rat ionotropic glutamate receptor ionotropic kaina... | 8568808 |
| Glutamate NMDA receptor | IC50 | = | 6500.0 | nM | 5.19 | Antagonistic activity against N-methyl-D-aspartate glutamate receptor 1 in Xenop... | 8568808 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8568808 | 10.1021/jm950323j | Glutamate receptor ionotropic, kainate | 1 |
| 8568808 | 10.1021/jm950323j | Glutamate NMDA receptor | 1 |
| 8568808 | 10.1021/jm950323j | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine