Compound Detail
CHEMBL314435
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 | CHEMBL314435 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QGKVAZYPYXLVGD-MAZHCROVSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
315.4
MW (Da)
0.97
ALogP
6
HBA
1
HBD
67.6
PSA (Ų)
0.89
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 8.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | EC50 | 8.43 | 8.43 | 3.7 | 1 |
| Unchecked CHEMBL612545 | EC50 | 7.43 | 7.43 | 37.0 | 1 |
| FM3A CHEMBL614297 | EC50 | 5.42 | 5.42 | 3800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | EC50 | = | 3.7 | nM | 8.43 | Antimalarial activity against Plasmodium falciparum assessed as growth inhibitio... | 24650700 |
| Unchecked | EC50 | = | 37.0 | nM | 7.43 | In vitro antimalarial activity against the Plasmodium falciparum FCR3 | 12036365 |
| FM3A | EC50 | = | 3800.0 | nM | 5.42 | In vitro cytotoxicity against mouse mammary FM3A cells | 12036365 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12036365 | 10.1021/jm010448q | FM3A | 2 |
| 12036365 | 10.1021/jm010448q | Plasmodium berghei | 2 |
| 12036365 | 10.1021/jm010448q | Unchecked | 1 |
| 24650700 | 10.1016/j.bmc.2014.02.040 | Plasmodium falciparum | 1 |
Data from ChEMBL 36 via Core Engine