Compound Detail
CHEMBL4111817
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Basic Information
| ChEMBL ID | CHEMBL4111817 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IMWRUEZSFIGPIN-VUUHIHSGSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
363.3
MW (Da)
0.93
ALogP
6
HBA
5
HBD
158.2
PSA (Ų)
0.32
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 4 CHEMBL2787 | EC50 | 6.68 | 6.68 | 210.0 | 1 |
| Metabotropic glutamate receptor 8 CHEMBL2718 | EC50 | 5.91 | 5.91 | 1230.0 | 1 |
| Metabotropic glutamate receptor 7 CHEMBL3879 | EC50 | 4.89 | 4.89 | 13000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 4 | EC50 | = | 210.0 | nM | 6.68 | Pharmacological Assay: Metabotropic glutamate receptors were transiently transfe... | - |
| Metabotropic glutamate receptor 8 | EC50 | = | 1230.0 | nM | 5.91 | Pharmacological Assay: Metabotropic glutamate receptors were transiently transfe... | - |
| Metabotropic glutamate receptor 7 | EC50 | = | 13000.0 | nM | 4.89 | Pharmacological Assay: Metabotropic glutamate receptors were transiently transfe... | - |
Data from ChEMBL 36 via Core Engine