Compound Detail
CHEMBL343790
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Basic Information
| ChEMBL ID | CHEMBL343790 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KLIHGCYEZYMBSX-OAHLLOKOSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
327.3
MW (Da)
4.10
ALogP
2
HBA
0
HBD
6.5
PSA (Ų)
0.80
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.36
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 CHEMBL287 | Ki | 8.36 | 8.36 | 4.3 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sigma non-opioid intracellular receptor 1 | Ki | = | 4.34 | nM | 8.36 | Binding affinity for sigma receptor using [3H](+)-pentazocine in guinea pig brai... | 1447735 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1447735 | 10.1021/jm00101a011 | Sigma non-opioid intracellular receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine