Compound Detail
CHEMBL471432
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Basic Information
| ChEMBL ID | CHEMBL471432 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XIVJRGMWNFYEQO-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
265.7
MW (Da)
1.88
ALogP
4
HBA
3
HBD
57.2
PSA (Ų)
0.70
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.72 | 7.12 | 18.9 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 18.95 | nM | 7.72 | Antimalarial activity against CQ-sensitive Plasmodium falciparum 3D7 | 34655985 |
| Plasmodium falciparum | IC50 | = | 304.57 | nM | 6.52 | Antimalarial activity against CQ-resistant Plasmodium falciparum W2 | 34655985 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 458801 | 10.1021/jm00191a008 | B16 | 4 |
| 458801 | 10.1021/jm00191a008 | P388 | 4 |
| 458801 | 10.1021/jm00191a008 | L1210 | 2 |
| 34655985 | 10.1016/j.ejmech.2021.113865 | Plasmodium falciparum | 2 |
| 19188070 | 10.1016/j.bmc.2009.01.013 | Mycobacterium tuberculosis | 1 |
Data from ChEMBL 36 via Core Engine