Compound Detail
CHEMBL433926
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Basic Information
| ChEMBL ID | CHEMBL433926 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JUPALBIYHVVPQE-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
383.9
MW (Da)
5.96
ALogP
4
HBA
2
HBD
48.4
PSA (Ų)
0.50
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.7 | 7.605 | 19.8 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 19.78 | nM | 7.7 | In vitro antimalarial activity against Plasmodium falciparum HB | 14584944 |
| Plasmodium falciparum | IC50 | = | 30.63 | nM | 7.51 | In vitro antimalarial activity against chloroquine-resistant Plasmodium falcipar... | 14584944 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14584944 | 10.1021/jm030796n | Plasmodium falciparum | 2 |
Data from ChEMBL 36 via Core Engine