Compound Detail
CHEMBL182196
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Basic Information
| ChEMBL ID | CHEMBL182196 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UOUHYLKUHXWOEV-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
305.9
MW (Da)
4.34
ALogP
3
HBA
1
HBD
28.2
PSA (Ų)
0.77
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 8.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | EC50 | 8.05 | 7.675 | 9.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | EC50 | = | 9.0 | nM | 8.05 | Effective concentration for Plasmodium falciparum 3D7 | 15686903 |
| Plasmodium falciparum | EC50 | = | 50.0 | nM | 7.3 | Effective concentration for Plasmodium falciparum W2 | 15686903 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15686903 | 10.1016/j.bmcl.2004.12.037 | Plasmodium falciparum | 2 |
Data from ChEMBL 36 via Core Engine