Compound Detail
CHEMBL138524
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL138524 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GTYAQPWFXVTMSN-JXMROGBWSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
319.4
MW (Da)
4.15
ALogP
4
HBA
0
HBD
48.4
PSA (Ų)
0.52
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.66
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 5.66 | 5.4867 | 2200.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 2200.0 | nM | 5.66 | Inhibition of [3H]hypoxanthine incorporation in Plasmodium falciparum K1 | 11728189 |
| Plasmodium falciparum | IC50 | = | 3300.0 | nM | 5.48 | Antimalarial activity against Plasmodium falciparum W2 | 16908136 |
| Plasmodium falciparum | IC50 | = | 4800.0 | nM | 5.32 | Antimalarial activity against Plasmodium falciparum D6 | 16908136 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16908136 | 10.1016/j.bmcl.2006.08.009 | Plasmodium falciparum | 3 |
| 11728189 | 10.1021/jm0101747 | Mus musculus | 2 |
| 11728189 | 10.1021/jm0101747 | Plasmodium falciparum | 1 |
| 11728189 | 10.1021/jm0101747 | Unchecked | 1 |
| 29602038 | 10.1016/j.ejmech.2018.03.047 | Leishmania donovani | 1 |
| 32179331 | 10.1016/j.ejmech.2020.112215 | Plasmodium | 1 |
Data from ChEMBL 36 via Core Engine