Compound Detail
CHEMBL540910
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Basic Information
| ChEMBL ID | CHEMBL540910 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZOIMUWKOBRZGID-UHFFFAOYSA-N |
| Parent Compound | CHEMBL457991 |
| Active Moiety | CHEMBL457991 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
302.2
MW (Da)
4.61
ALogP
0
HBA
1
HBD
19.7
PSA (Ų)
0.46
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.35 | 7.35 | 45.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 45.0 | nM | 7.35 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum K1 | 18395298 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18395298 | 10.1016/j.ejmech.2008.02.005 | Plasmodium falciparum | 1 |
Data from ChEMBL 36 via Core Engine