Compound Detail
CHEMBL224260
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 | CHEMBL224260 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | UYVBLRHPOKUXKQ-RPPGKUMJSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
454.9
MW (Da)
2.62
ALogP
7
HBA
4
HBD
127.3
PSA (Ų)
0.35
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 6.6 | 6.6 | 250.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 250.0 | nM | 6.6 | Antiparasitic activity against Plasmodium falciparum W2 | 17052908 |
| Plasmodium falciparum | IC50 | = | 250.0 | nM | 6.6 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum W2 | 19361896 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17052908 | 10.1016/j.bmc.2006.09.055 | Falcipain 2 | 1 |
| 17052908 | 10.1016/j.bmc.2006.09.055 | Plasmodium falciparum | 1 |
| 19361896 | 10.1016/j.ejmech.2009.02.024 | Plasmodium falciparum | 1 |
| 19361896 | 10.1016/j.ejmech.2009.02.024 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine