Compound Detail
CHEMBL95247
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 | CHEMBL95247 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FXCXOYFIDLBWSR-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
388.5
MW (Da)
4.88
ALogP
3
HBA
0
HBD
36.7
PSA (Ų)
0.60
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Mu-type opioid receptor CHEMBL270 | Ki | 9.52 | 9.46 | 0.3 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Mu-type opioid receptor | Ki | = | 0.3 | nM | 9.52 | Ability to displace [3H]naloxone from the Opioid receptor mu 1 isolated from the... | 2170652 |
| Mu-type opioid receptor | Ki | = | 0.4 | nM | 9.4 | Ability to displace [3H]naloxone from the Opioid receptor mu 1 isolated from the... | 2170652 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2170652 | 10.1021/jm00172a032 | Mus musculus | 4 |
| 2170652 | 10.1021/jm00172a032 | Mu-type opioid receptor | 2 |
Data from ChEMBL 36 via Core Engine