Compound Detail
CHEMBL3219642
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Basic Information
| ChEMBL ID | CHEMBL3219642 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XIJSXBGFRPKLGZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
237.3
MW (Da)
3.32
ALogP
2
HBA
1
HBD
42.1
PSA (Ų)
0.74
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 5.17 | 5.17 | 6725.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 6725.0 | nM | 5.17 | Antimalarial activity against wild type Plasmodium falciparum 3D7 assessed as gr... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1039/C1MD00183C | Plasmodium falciparum | 1 |
Data from ChEMBL 36 via Core Engine