Compound Detail
CHEMBL551476
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Basic Information
| ChEMBL ID | CHEMBL551476 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PXFWCGNWAXZVFY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
460.1
MW (Da)
5.26
ALogP
5
HBA
2
HBD
43.4
PSA (Ų)
0.36
QED
1
Ro5 Violations
15
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.02
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 8.02 | 8.02 | 9.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 9.5 | nM | 8.02 | Antimalarial activity against Plasmodium falciparum FcB1/Columbia erythrocytes i... | 19361896 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19361896 | 10.1016/j.ejmech.2009.02.024 | Plasmodium falciparum | 1 |
| 19361896 | 10.1016/j.ejmech.2009.02.024 | MRC5 | 1 |
| 19361896 | 10.1016/j.ejmech.2009.02.024 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine