Compound Detail
CHEMBL5287020
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Basic Information
| ChEMBL ID | CHEMBL5287020 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IOBKFLRBUCYZIN-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
364.4
MW (Da)
4.77
ALogP
3
HBA
2
HBD
68.1
PSA (Ų)
0.38
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 10.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 10.7 | 9.5033 | 0.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 0.02 | nM | 10.7 | Antiplasmodial activity against Plasmodium falciparum Dd2 infected in human Eryt... | 29360043 |
| Plasmodium falciparum | IC50 | = | 0.02 | nM | 10.7 | Antiplasmodial activity against Plasmodium falciparum D6 infected in human Eryth... | 29360043 |
| Plasmodium falciparum | IC50 | = | 78.0 | nM | 7.11 | Antiplasmodial activity against Plasmodium falciparum Tm90-C2B infected in human... | 29360043 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29360043 | 10.1016/j.ejmech.2018.01.039 | Plasmodium falciparum | 3 |
Data from ChEMBL 36 via Core Engine