Compound Detail
CHEMBL2093168
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Basic Information
| ChEMBL ID | CHEMBL2093168 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UOFHJPYBNNVXKU-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
384.9
MW (Da)
5.22
ALogP
4
HBA
2
HBD
59.0
PSA (Ų)
0.65
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.58
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Brugia malayi CHEMBL613140 | IC50 | 6.58 | 6.165 | 260.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Brugia malayi | IC50 | = | 260.0 | nM | 6.58 | WHO-TDR: Lymphatic Filariasis | - |
| Brugia malayi | IC50 | = | 1770.0 | nM | 5.75 | WHO-TDR: Lymphatic Filariasis | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL2093137 | Brugia malayi | 4 |
| - | 10.6019/CHEMBL2093137 | Schistosoma mansoni | 1 |
| - | 10.6019/CHEMBL2093137 | Onchocerca lienalis | 1 |
| - | 10.6019/CHEMBL2093137 | MRC5 | 1 |
| - | 10.6019/CHEMBL2093137 | Plasmodium falciparum K1 | 1 |
| - | 10.6019/CHEMBL2093137 | Trypanosoma cruzi | 1 |
| - | 10.6019/CHEMBL2093137 | Trypanosoma brucei brucei | 1 |
| - | 10.6019/CHEMBL2093137 | Leishmania infantum | 1 |
Data from ChEMBL 36 via Core Engine