Compound Detail
CHEMBL3133885
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Basic Information
| ChEMBL ID | CHEMBL3133885 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YSKYRPZOEKFCGP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
400.4
MW (Da)
4.36
ALogP
5
HBA
1
HBD
68.5
PSA (Ų)
0.71
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Metabotropic glutamate receptor 2 CHEMBL5137 | IC50 | 7.04 | 7.04 | 91.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Metabotropic glutamate receptor 2 | IC50 | = | 91.0 | nM | 7.04 | Non-competitive antagonist activity at human recombinant mGluR2 expressed in Che... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C3MD00110E | No relevant target | 2 |
| - | 10.1039/C3MD00110E | Albumin | 1 |
| - | 10.1039/C3MD00110E | Metabotropic glutamate receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine