Compound Detail
CHEMBL325238
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 | CHEMBL325238 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HQGDPZPNAXRCSA-UHFFFAOYSA-N |
3
Targets
4
Activities
2
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
293.4
MW (Da)
4.89
ALogP
1
HBA
0
HBD
3.2
PSA (Ų)
0.69
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.78
Ki 2 meas. best 9.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 CHEMBL287 | Ki | 9.1 | 9.05 | 0.8 | 2 |
| D(2) dopamine receptor CHEMBL339 | IC50 | 6.78 | 6.78 | 165.0 | 1 |
| D(2) dopamine receptor CHEMBL3998 | IC50 | 6.47 | 6.47 | 335.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 | Ki | = | 0.8 | nM | 9.1 | The compound was tested for its binding affinity towards Sigma opioid receptor i... | 1662725 |
| Sigma non-opioid intracellular receptor 1 | Ki | = | 1.0 | nM | 9.0 | Binding affinity against sigma receptor in bovine cerebellum using 2.0 nM [3H]ha... | 7902869 |
| D(2) dopamine receptor | IC50 | = | 165.0 | nM | 6.78 | Compound was tested for its binding affinity towards Dopamine receptor D2 by usi... | 1662725 |
| D(2) dopamine receptor | IC50 | = | 335.0 | nM | 6.47 | Binding affinity against Dopamine receptor D2 in bovine striatal homogenate usin... | 7902869 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23981939 | 10.1016/j.bmc.2013.07.045 | RAW264.7 | 4 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| 1662725 | 10.1021/jm00116a003 | Sigma non-opioid intracellular receptor 1 | 1 |
| 1662725 | 10.1021/jm00116a003 | D(1A) dopamine receptor | 1 |
| 1662725 | 10.1021/jm00116a003 | D(2) dopamine receptor | 1 |
| 1662725 | 10.1021/jm00116a003 | Rattus norvegicus | 1 |
| 7902869 | 10.1021/jm00076a021 | Sigma non-opioid intracellular receptor 1 | 1 |
| 7902869 | 10.1021/jm00076a021 | D(2) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine