Compound Detail
CHEMBL3221189
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Basic Information
| ChEMBL ID | CHEMBL3221189 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | STEMEZOWSYEKBF-PDGQHHTCSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
384.9
MW (Da)
4.60
ALogP
4
HBA
0
HBD
41.9
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.78
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| N-arachidonyl glycine receptor CHEMBL2384898 | IC50 | 5.78 | 5.78 | 1650.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| N-arachidonyl glycine receptor | IC50 | = | 1650.0 | nM | 5.78 | Antagonist activity against human GPR18 expressed in CHO cells assessed as reduc... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C3MD00394A | G-protein coupled receptor 55 | 3 |
| - | 10.1039/C3MD00394A | N-arachidonyl glycine receptor | 2 |
| - | 10.1039/C3MD00394A | Cannabinoid receptor 2 | 2 |
| - | 10.1039/C3MD00394A | Cannabinoid receptor 1 | 2 |
Data from ChEMBL 36 via Core Engine