Compound Detail
CHEMBL5403415
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Basic Information
| ChEMBL ID | CHEMBL5403415 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QUFYBPDDFCSWMH-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
548.1
MW (Da)
4.12
ALogP
9
HBA
4
HBD
129.7
PSA (Ų)
0.30
QED
1
Ro5 Violations
10
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.85 | 5.48 | 1400.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 1400.0 | nM | 5.85 | Inhibition of Plasmodium falciparum ARK3 incubated for 2 hrs by luciferin-reagen... | 38116430 |
| Unchecked | IC50 | = | 5000.0 | nM | 5.3 | Inhibition of Plasmodium falciparum PKB incubated for 2 hrs by luciferin-reagent... | 38116430 |
| Unchecked | IC50 | = | 5100.0 | nM | 5.29 | Inhibition of Plasmodium falciparum ARK1 incubated for 2 hrs by luciferin-reagen... | 38116430 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38116430 | 10.1021/acsmedchemlett.3c00354 | Unchecked | 8 |
Data from ChEMBL 36 via Core Engine