Compound Detail
CHEMBL3220024
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Basic Information
| ChEMBL ID | CHEMBL3220024 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XNRVKWBQYRFTEK-FMIVXFBMSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
407.5
MW (Da)
4.79
ALogP
4
HBA
2
HBD
63.2
PSA (Ų)
0.40
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.63
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium berghei CHEMBL612653 | IC50 | 5.63 | 5.63 | 2330.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium berghei | IC50 | = | 2330.0 | nM | 5.63 | Antiplasmodial activity against liver stage of Plasmodium berghei sporozoites ex... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C2MD20113E | Plasmodium berghei | 2 |
| - | 10.1039/C2MD20113E | Plasmodium falciparum | 1 |
| - | 10.1039/C2MD20113E | ADMET | 1 |
Data from ChEMBL 36 via Core Engine