Compound Detail
CHEMBL4760974
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Basic Information
| ChEMBL ID | CHEMBL4760974 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LZGHUZDVFBBPKD-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
475.7
MW (Da)
5.35
ALogP
3
HBA
1
HBD
52.6
PSA (Ų)
0.52
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.37
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mu-type opioid receptor CHEMBL233 | EC50 | 6.37 | 6.335 | 426.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mu-type opioid receptor | EC50 | = | 426.0 | nM | 6.37 | Agonist activity at EA-fragment beta-arrestin-tagged human MOR expressed in huma... | 33170687 |
| Mu-type opioid receptor | EC50 | = | 502.0 | nM | 6.3 | Agonist activity at EA-fragment beta-arrestin-tagged human MOR expressed in huma... | 33170687 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33170687 | 10.1021/acs.jmedchem.0c00901 | Mu-type opioid receptor | 4 |
| 33170687 | 10.1021/acs.jmedchem.0c00901 | Delta-type opioid receptor | 4 |
| 33170687 | 10.1021/acs.jmedchem.0c00901 | Opioid receptors; mu & delta | 2 |
Data from ChEMBL 36 via Core Engine