Compound Detail
CHEMBL5174248
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 | CHEMBL5174248 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WFRKWFGDMVSAAW-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
409.5
MW (Da)
5.01
ALogP
3
HBA
1
HBD
32.7
PSA (Ų)
0.66
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.51
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | EC50 | 6.51 | 6.2667 | 310.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | EC50 | = | 310.0 | nM | 6.51 | Antiplasmodial activity against chloroquine-sensitive Plasmodium falciparum D6 a... | 35091169 |
| Plasmodium falciparum | EC50 | = | 530.0 | nM | 6.28 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum Dd2 as... | 35091169 |
| Plasmodium falciparum | EC50 | = | 970.0 | nM | 6.01 | Antiplasmodial activity against artemisinin-resistant Plasmodium falciparum ARC0... | 35091169 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35091169 | 10.1016/j.bmc.2022.116629 | No relevant target | 4 |
| 35091169 | 10.1016/j.bmc.2022.116629 | Plasmodium falciparum | 3 |
| 35091169 | 10.1016/j.bmc.2022.116629 | HepG2 | 1 |
| 35091169 | 10.1016/j.bmc.2022.116629 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine