Compound Detail
CHEMBL471254
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Basic Information
| ChEMBL ID | CHEMBL471254 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HYANPVXCNXDNLW-DHZHZOJOSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
312.3
MW (Da)
3.79
ALogP
5
HBA
0
HBD
103.3
PSA (Ų)
0.36
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.09
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 5.09 | 5.085 | 8200.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 8200.0 | nM | 5.09 | Antimalarial activity after 24 hrs against chloroquine-resistant Plasmodium falc... | 19250824 |
| Plasmodium falciparum | IC50 | = | 8300.0 | nM | 5.08 | Antimalarial activity after 24 hrs against chloroquine-sensitive Plasmodium falc... | 19250824 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19250824 | 10.1016/j.bmcl.2009.02.042 | Plasmodium falciparum | 2 |
| 19250824 | 10.1016/j.bmcl.2009.02.042 | Protein kinase Pfmrk | 1 |
| 19250824 | 10.1016/j.bmcl.2009.02.042 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine