Compound Detail
CHEMBL1159833
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 | CHEMBL1159833 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YICPFUCSYSAEOE-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
358.5
MW (Da)
3.60
ALogP
3
HBA
2
HBD
66.6
PSA (Ų)
0.85
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Opioid receptor CHEMBL2094129 | IC50 | 5.82 | 5.51 | 1503.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Opioid receptor | IC50 | = | 1503.0 | nM | 5.82 | Compound was tested for its ability to displace [3H]naloxone from Opioid recepto... | 6273560 |
| Opioid receptor | IC50 | = | 6384.0 | nM | 5.2 | Compound was tested for its ability to displace [3H]naloxone from Opioid recepto... | 6273560 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6273560 | 10.1021/jm00143a007 | Opioid receptor | 2 |
Data from ChEMBL 36 via Core Engine