Compound Detail
CHEMBL519708
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Basic Information
| ChEMBL ID | CHEMBL519708 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AFQBCKMNPWLDPU-UHFFFAOYSA-N |
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
277.8
MW (Da)
3.69
ALogP
3
HBA
2
HBD
37.0
PSA (Ų)
0.76
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 7.75
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.75 | 6.8975 | 18.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 18.0 | nM | 7.75 | Antimalarial activity against chloroquine-sensitive Plasmodium falciparum HB3 af... | 18512900 |
| Plasmodium falciparum | IC50 | = | 26.0 | nM | 7.58 | Antimalarial activity against chloroquine-sensitive Plasmodium falciparum GCO3 a... | 18512900 |
| Plasmodium falciparum | IC50 | = | 649.0 | nM | 6.19 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum Dd2 af... | 18512900 |
| Plasmodium falciparum | IC50 | = | 854.0 | nM | 6.07 | 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