Compound Detail
CHEMBL5288684
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Basic Information
| ChEMBL ID | CHEMBL5288684 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WNOBXZCVHKBBRW-QSVDSNPCSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
375.5
MW (Da)
2.64
ALogP
8
HBA
1
HBD
83.3
PSA (Ų)
0.81
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 8.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 8.68 | 8.5025 | 2.1 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 2.1 | nM | 8.68 | Antimalarial activity against Plasmodium falciparum Dd2 | 33508479 |
| Plasmodium falciparum | IC50 | = | 2.9 | nM | 8.54 | Antimalarial activity against Plasmodium falciparum 3D7 | 33508479 |
| Plasmodium falciparum | IC50 | = | 3.4 | nM | 8.47 | Antimalarial activity against Plasmodium falciparum IPC5202 | 33508479 |
| Plasmodium falciparum | IC50 | = | 4.8 | nM | 8.32 | Antimalarial activity against Plasmodium falciparum IPC4912 | 33508479 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33508479 | 10.1016/j.ejmech.2021.113193 | Plasmodium falciparum | 4 |
Data from ChEMBL 36 via Core Engine