Compound Detail
CHEMBL5289093
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Basic Information
| ChEMBL ID | CHEMBL5289093 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QXVJXXGVUXYYHH-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
465.5
MW (Da)
5.45
ALogP
7
HBA
2
HBD
87.9
PSA (Ų)
0.41
QED
1
Ro5 Violations
9
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 | 6.42 | 380.0 | 1 |
| Plasmodium berghei CHEMBL612653 | IC50 | 5.27 | 5.27 | 5400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 380.0 | nM | 6.42 | Antimalarial activity against CQ-sensitive Plasmodium falciparum 3D7 | 34655985 |
| Plasmodium berghei | IC50 | = | 5400.0 | nM | 5.27 | Antimalarial activity against liver stage Plasmodium berghei | 34655985 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 34655985 | 10.1016/j.ejmech.2021.113865 | Plasmodium falciparum | 1 |
| 34655985 | 10.1016/j.ejmech.2021.113865 | Plasmodium berghei | 1 |
Data from ChEMBL 36 via Core Engine