Compound Detail
CHEMBL497996
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Basic Information
| ChEMBL ID | CHEMBL497996 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SVGWSQQYSMINGG-LFYBBSHMSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
307.8
MW (Da)
5.03
ALogP
2
HBA
0
HBD
22.0
PSA (Ų)
0.49
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.02
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 5.02 | 5.02 | 9500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 9500.0 | nM | 5.02 | Antiplasmodial activity against chloroquine-sensitive Plasmodium falciparum 3D7 ... | 19269069 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19269069 | 10.1016/j.ejmech.2009.02.008 | Plasmodium falciparum | 6 |
| 17977622 | 10.1016/j.ejmech.2007.09.014 | Plasmodium falciparum | 1 |
| 26580979 | 10.1016/j.ejmech.2015.10.047 | Mycobacterium tuberculosis | 1 |
| 26580979 | 10.1016/j.ejmech.2015.10.047 | Staphylococcus aureus | 1 |
| 26580979 | 10.1016/j.ejmech.2015.10.047 | Escherichia coli | 1 |
Data from ChEMBL 36 via Core Engine