Compound Detail
CHEMBL145371
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Basic Information
| ChEMBL ID | CHEMBL145371 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | POUSMXNITPRXFI-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
428.6
MW (Da)
5.90
ALogP
3
HBA
0
HBD
15.7
PSA (Ų)
0.49
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Delta-type opioid receptor CHEMBL269 | IC50 | 5.75 | 5.75 | 1800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Delta-type opioid receptor | IC50 | = | 1800.0 | nM | 5.75 | Binding affinity was measured against Opioid receptor delta 1 using [3H]p-Cl-DPD... | 9822547 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9822547 | 10.1021/jm980374r | Mu-type opioid receptor | 1 |
| 9822547 | 10.1021/jm980374r | Delta-type opioid receptor | 1 |
Data from ChEMBL 36 via Core Engine