Compound Detail
CHEMBL6047114
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Basic Information
| ChEMBL ID | CHEMBL6047114 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FRQLLZUIPUDEIZ-UHFFFAOYSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
373.5
MW (Da)
3.83
ALogP
4
HBA
0
HBD
46.6
PSA (Ų)
0.77
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 8.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sigma intracellular receptor 2 CHEMBL4105907 | Ki | 8.85 | 8.85 | 1.4 | 3 |
| Unchecked CHEMBL612545 | Ki | 8.85 | 8.85 | 1.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sigma intracellular receptor 2 | Ki | = | 1.4 | nM | 8.85 | Competitive Radioligand Binding Assay 2: The affinity of candidate sigma-2 ligan... | - |
| Sigma intracellular receptor 2 | Ki | = | 1.4 | nM | 8.85 | Radioligand Binding Assay: Radioligand binding assays for Sigma-1 receptors and ... | - |
| Sigma intracellular receptor 2 | Ki | = | 1.4 | nM | 8.85 | Competitive Radioligand Binding Assay: Radioligand binding assays for Sigma-1 re... | - |
| Unchecked | Ki | = | 1.4 | nM | 8.85 | Competitive Radioligand Binding Assay: The affinity of candidate sigma-2 ligand ... | - |
Data from ChEMBL 36 via Core Engine