Compound Detail
CHEMBL146305
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Basic Information
| ChEMBL ID | CHEMBL146305 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LKLJCPMWOOHEMD-VQHVLOKHSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
353.8
MW (Da)
4.80
ALogP
4
HBA
0
HBD
48.4
PSA (Ų)
0.38
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 6.29 | 6.215 | 510.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 510.0 | nM | 6.29 | In vitro antimalarial activity against chloroquine-resistant Plasmodium falcipar... | 8544179 |
| Plasmodium falciparum | IC50 | = | 720.0 | nM | 6.14 | In vitro antimalarial activity against chloroquine-sensitive Plasmodium falcipar... | 8544179 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8544179 | 10.1021/jm00026a010 | Plasmodium falciparum | 2 |
| 8544179 | 10.1021/jm00026a010 | Unchecked | 1 |
| 34655985 | 10.1016/j.ejmech.2021.113865 | Hemozoin | 1 |
Data from ChEMBL 36 via Core Engine