Compound Detail
CHEMBL5409840
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Basic Information
| ChEMBL ID | CHEMBL5409840 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XXEHPANALJTLPJ-CTNGQTDRSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
367.5
MW (Da)
3.32
ALogP
3
HBA
3
HBD
64.6
PSA (Ų)
0.67
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.61
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mu-type opioid receptor CHEMBL233 | EC50 | 6.61 | 6.61 | 243.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mu-type opioid receptor | EC50 | = | 243.0 | nM | 6.61 | Agonist activity at human mu opioid receptor stably transfected in CHO cells by ... | 37414346 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37414346 | 10.1016/j.bmcl.2023.129405 | Mu-type opioid receptor | 2 |
Data from ChEMBL 36 via Core Engine