Compound Detail
CHEMBL121113
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Basic Information
| ChEMBL ID | CHEMBL121113 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IMXVNEJUSJQSBB-NSHGMRRFSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
351.4
MW (Da)
3.13
ALogP
3
HBA
3
HBD
86.6
PSA (Ų)
0.74
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, kainate 2 CHEMBL3607 | Ki | 8.68 | 8.68 | 2.1 | 1 |
| Glutamate receptor ionotropic, kainate 2 CHEMBL3683 | Ki | 7.04 | 7.04 | 90.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, kainate 2 | Ki | = | 2.1 | nM | 8.68 | Inhibition of [3H]kainate binding at rat forebrain ionotropic glutamate receptor... | 8809152 |
| Glutamate receptor ionotropic, kainate 2 | Ki | = | 90.6 | nM | 7.04 | Inhibition of [3H]kainate binding at ionotropic glutamate receptor kainate 2 | 8809152 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8809152 | 10.1021/jm960155a | Glutamate receptor ionotropic, kainate 2 | 5 |
Data from ChEMBL 36 via Core Engine