Compound Detail
CHEMBL419343
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Basic Information
| ChEMBL ID | CHEMBL419343 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FTFOZMMDMFOELO-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
348.5
MW (Da)
4.37
ALogP
2
HBA
1
HBD
32.3
PSA (Ų)
0.89
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 8.25
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 CHEMBL287 | Ki | 8.25 | 8.25 | 5.7 | 1 |
| Sigma non-opioid intracellular receptor 1 CHEMBL3602 | Ki | 5.85 | 5.85 | 1410.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 | Ki | = | 5.68 | nM | 8.25 | Binding affinity measured on Sigma receptor type 1 from guinea pig brain membran... | 7636860 |
| Sigma non-opioid intracellular receptor 1 | Ki | = | 1410.0 | nM | 5.85 | Binding affinity at Sigma receptor type 2 on rat liver membranes receptor by [3H... | 7636860 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7636860 | 10.1021/jm00015a022 | Sigma non-opioid intracellular receptor 1 | 3 |
Data from ChEMBL 36 via Core Engine