Compound Detail
CHEMBL570849
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Basic Information
| ChEMBL ID | CHEMBL570849 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CJUWCQRHWFPLGN-FPYGCLRLSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
343.2
MW (Da)
5.08
ALogP
3
HBA
0
HBD
34.9
PSA (Ų)
0.49
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.93
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 5.93 | 5.93 | 1180.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 1180.32 | nM | 5.93 | Inhibition of Plasmodium falciparum W2 | - |
| Plasmodium falciparum | IC50 | = | 1180.0 | nM | 5.93 | Inhibition of Plasmodium falciparum W2 | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1007/s00044-011-9900-1 | Plasmodium falciparum | 2 |
| 19664864 | 10.1016/j.ejmech.2009.06.038 | Leishmania major | 1 |
| 19664864 | 10.1016/j.ejmech.2009.06.038 | Aspergillus niger | 1 |
| 19664864 | 10.1016/j.ejmech.2009.06.038 | Yarrowia lipolytica | 1 |
| 19664864 | 10.1016/j.ejmech.2009.06.038 | Trichoderma viride | 1 |
| 19664864 | 10.1016/j.ejmech.2009.06.038 | Aspergillus fumigatus | 1 |
| 19664864 | 10.1016/j.ejmech.2009.06.038 | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine