Compound Detail
CHEMBL5271313
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Basic Information
| ChEMBL ID | CHEMBL5271313 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PAGHJJMXITYTPR-CQSZACIVSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
391.4
MW (Da)
2.74
ALogP
7
HBA
0
HBD
74.5
PSA (Ų)
0.66
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 7.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 7 CHEMBL3879 | EC50 | 7.37 | 7.37 | 42.7 | 2 |
| Unchecked CHEMBL612545 | EC50 | 6.72 | 6.72 | 190.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 7 | EC50 | = | 43.0 | nM | 7.37 | Positive allosteric modulation of rat mGluR7 | 36528230 |
| Metabotropic glutamate receptor 7 | EC50 | = | 42.66 | nM | 7.37 | Positive allosteric modulation of rat mGluR7 | 36528230 |
| Unchecked | EC50 | = | 190.0 | nM | 6.72 | Positive allosteric modulation of rat mGluR8 | 36528230 |
| Unchecked | EC50 | = | 190.55 | nM | 6.72 | Positive allosteric modulation of rat mGluR8 | 36528230 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36528230 | 10.1016/j.bmcl.2022.129106 | Metabotropic glutamate receptor 7 | 3 |
| 36528230 | 10.1016/j.bmcl.2022.129106 | Unchecked | 3 |
Data from ChEMBL 36 via Core Engine