Compound Detail
CHEMBL367738
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Basic Information
| ChEMBL ID | CHEMBL367738 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VFAJYYGKZZDBFN-UHFFFAOYSA-N |
1
Targets
7
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
182.2
MW (Da)
2.68
ALogP
2
HBA
0
HBD
17.8
PSA (Ų)
0.52
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 7 meas. best 6.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 6.32 | 5.99 | 480.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 480.0 | nM | 6.32 | Antimalarial activity against chloroquine and pyrimethamine-resistant Plasmodium... | 19781948 |
| Plasmodium falciparum | IC50 | = | 2200.0 | nM | 5.66 | Antiplasmodial activity against chloroquine-resistant Plasmodium falciparum K1 | 11300877 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11300877 | 10.1021/jm0010419 | Trypanosoma cruzi | 4 |
| 11300877 | 10.1021/jm0010419 | Plasmodium falciparum | 2 |
| 11300877 | 10.1021/jm0010419 | L6 | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | Plasmodium falciparum | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | L6 | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | Trypanosoma brucei rhodesiense | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | Unchecked | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | Trypanosoma cruzi | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | Leishmania donovani | 1 |
Data from ChEMBL 36 via Core Engine