Compound Detail
CHEMBL4281618
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Basic Information
| ChEMBL ID | CHEMBL4281618 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ULLQSEUDUAYVHW-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
487.1
MW (Da)
5.99
ALogP
4
HBA
2
HBD
57.3
PSA (Ų)
0.20
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 8.31
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 8.31 | 8.155 | 4.9 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 4.9 | nM | 8.31 | Antiplasmodial activity against chloroquine-sensitive Plasmodium falciparum FCR-... | 30344903 |
| Plasmodium falciparum | IC50 | = | 10.0 | nM | 8.0 | Antiplasmodial activity against chloroquine-resistant Plasmodium falciparum K1 i... | 30344903 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30344903 | 10.1021/acsmedchemlett.8b00222 | Plasmodium falciparum | 3 |
| 30344903 | 10.1021/acsmedchemlett.8b00222 | MRC5 | 1 |
| 30344903 | 10.1021/acsmedchemlett.8b00222 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine