Compound Detail
CHEMBL280801
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL280801 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VODDPJUIQWNVTH-MOPGFXCFSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
320.5
MW (Da)
4.36
ALogP
2
HBA
0
HBD
6.5
PSA (Ų)
0.76
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mu-type opioid receptor CHEMBL270 | IC50 | 6.42 | 6.42 | 380.0 | 1 |
| Delta-type opioid receptor CHEMBL236 | IC50 | 6.38 | 6.38 | 420.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mu-type opioid receptor | IC50 | = | 380.0 | nM | 6.42 | Binding affinity towards mu opioid receptor using [3H]- -DAMGO (1.5 nM) as radio... | 10340622 |
| Delta-type opioid receptor | IC50 | = | 420.0 | nM | 6.38 | Binding inhibition of [3H]- -naltrindole (0.15 nM) to membranes in CHO cells exp... | 10340622 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10340622 | 10.1016/s0960-894x(99)00173-0 | Delta-type opioid receptor | 1 |
| 10340622 | 10.1016/s0960-894x(99)00173-0 | Mu-type opioid receptor | 1 |
Data from ChEMBL 36 via Core Engine