Compound Detail
CHEMBL5427728
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Basic Information
| ChEMBL ID | CHEMBL5427728 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VEPUFGGUDYIKAK-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
216.7
MW (Da)
2.93
ALogP
2
HBA
1
HBD
24.9
PSA (Ų)
0.78
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 6.42 | 6.405 | 377.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 377.0 | nM | 6.42 | Antimalarial activity against chloroquine-sensitive Plasmodium falciparum 3D7 as... | 37163950 |
| Plasmodium falciparum | IC50 | = | 405.0 | nM | 6.39 | Antimalarial activity against multi-drug resistant Plasmodium falciparum K1 asse... | 37163950 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37163950 | 10.1016/j.ejmech.2023.115458 | Plasmodium falciparum | 2 |
| 37163950 | 10.1016/j.ejmech.2023.115458 | HepG2 | 1 |
Data from ChEMBL 36 via Core Engine