Compound Detail
CHEMBL486501
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Basic Information
| ChEMBL ID | CHEMBL486501 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ICDQGVWQKAXLKM-UHFFFAOYSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
291.8
MW (Da)
4.08
ALogP
3
HBA
2
HBD
37.0
PSA (Ų)
0.72
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.68 | 6.725 | 21.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 21.0 | nM | 7.68 | Antimalarial activity against chloroquine-sensitive Plasmodium falciparum HB3 af... | 18512900 |
| Plasmodium falciparum | IC50 | = | 62.0 | nM | 7.21 | Antimalarial activity against chloroquine-sensitive Plasmodium falciparum GCO3 a... | 18512900 |
| Plasmodium falciparum | IC50 | = | 786.0 | nM | 6.11 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum Dd2 af... | 18512900 |
| Plasmodium falciparum | IC50 | = | 1270.0 | nM | 5.9 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum FCB af... | 18512900 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18512900 | 10.1021/jm701478a | Plasmodium falciparum | 6 |
Data from ChEMBL 36 via Core Engine