Compound Detail
CHEMBL418462
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Basic Information
| ChEMBL ID | CHEMBL418462 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BXTHDFVMVOKYQK-ZWNOBZJWSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
298.7
MW (Da)
0.78
ALogP
4
HBA
3
HBD
103.9
PSA (Ų)
0.76
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 2 CHEMBL5137 | IC50 | 4.12 | 4.12 | 75000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 2 | IC50 | = | 75000.0 | nM | 4.12 | In vitro antagonist activity at recombinant human Metabotropic glutamate recepto... | 9873471 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9873471 | 10.1016/s0960-894x(98)00352-7 | Metabotropic glutamate receptor 1 | 1 |
| 9873471 | 10.1016/s0960-894x(98)00352-7 | Metabotropic glutamate receptor 5 | 1 |
| 9873471 | 10.1016/s0960-894x(98)00352-7 | Metabotropic glutamate receptor 2 | 1 |
| 9873471 | 10.1016/s0960-894x(98)00352-7 | Metabotropic glutamate receptor 3 | 1 |
| 9873471 | 10.1016/s0960-894x(98)00352-7 | Metabotropic glutamate receptor 4 | 1 |
| 9873471 | 10.1016/s0960-894x(98)00352-7 | Metabotropic glutamate receptor 8 | 1 |
Data from ChEMBL 36 via Core Engine