Compound Detail
CHEMBL3298604
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Basic Information
| ChEMBL ID | CHEMBL3298604 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BKTTXGRARKKJNK-HKOYGPOVSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
338.4
MW (Da)
4.30
ALogP
5
HBA
1
HBD
77.3
PSA (Ų)
0.28
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.77 | 7.695 | 17.1 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 17.1 | nM | 7.77 | Antimalarial activity against Plasmodium falciparum K1 assessed as inhibition of... | 24856305 |
| Plasmodium falciparum | IC50 | = | 24.0 | nM | 7.62 | Antimalarial activity against Plasmodium falciparum NFS4 assessed as inhibition ... | 24856305 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24856305 | 10.1016/j.bmc.2014.04.066 | Plasmodium falciparum | 2 |
Data from ChEMBL 36 via Core Engine