Compound Detail
CHEMBL5905642
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Basic Information
| ChEMBL ID | CHEMBL5905642 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AYOSFSSBJBQFAL-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
377.5
MW (Da)
3.26
ALogP
4
HBA
1
HBD
50.5
PSA (Ų)
0.80
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 8.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mu-type opioid receptor CHEMBL233 | EC50 | 8.0 | 8.0 | 10.0 | 1 |
| Beta-arrestin-1 CHEMBL1795088 | EC50 | 6.57 | 6.57 | 270.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mu-type opioid receptor | EC50 | = | 10.0 | nM | 8.0 | G-Protein Assay: G-protein signaling was measured via second messenger cAMP modu... | - |
| Beta-arrestin-1 | EC50 | = | 270.0 | nM | 6.57 | beta-Arrestin Assay: The DISCOVERX PATHHUNTER® β-Arrestin assay is used to measu... | - |
Data from ChEMBL 36 via Core Engine