Compound Detail
CHEMBL281030
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Basic Information
| ChEMBL ID | CHEMBL281030 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AFFWXMUEFYWYJZ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
353.3
MW (Da)
1.65
ALogP
6
HBA
3
HBD
125.0
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA CHEMBL2093871 | IC50 | 7.51 | 7.51 | 31.0 | 1 |
| Glutamate NMDA receptor CHEMBL1907608 | IC50 | 5.8 | 5.8 | 1600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glutamate receptor ionotropic, AMPA | IC50 | = | 31.0 | nM | 7.51 | Affinity towards Ionotropic glutamate receptor AMPA using [3H]AMPA as ligand on ... | 11206442 |
| Glutamate NMDA receptor | IC50 | = | 1600.0 | nM | 5.8 | In vitro binding affinity towards NMDA glutamate receptor using [3H]5,7-dichloro... | 11206442 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11206442 | 10.1016/s0960-894x(00)00592-8 | Glutamate receptor ionotropic, AMPA | 1 |
| 11206442 | 10.1016/s0960-894x(00)00592-8 | Glutamate NMDA receptor | 1 |
| 11206442 | 10.1016/s0960-894x(00)00592-8 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine