Compound Detail
CHEMBL3559406
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Basic Information
| ChEMBL ID | CHEMBL3559406 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CHXGWMSPGKKPCQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
264.8
MW (Da)
1.85
ALogP
4
HBA
3
HBD
63.0
PSA (Ų)
0.70
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.22 | 7.22 | 60.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 60.0 | nM | 7.22 | Antimicrobial activity against chloroquine-resistant Plasmodium falciparum W2 in... | 25461328 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26116178 | 10.1016/j.bmc.2015.06.029 | Mus musculus | 4 |
| 25461328 | 10.1016/j.ejmech.2014.11.022 | Plasmodium falciparum | 1 |
Data from ChEMBL 36 via Core Engine