Compound Detail
CHEMBL4278900
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Basic Information
| ChEMBL ID | CHEMBL4278900 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MANUURYPOJRHJB-CYBMUJFWSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
295.4
MW (Da)
5.20
ALogP
2
HBA
1
HBD
33.1
PSA (Ų)
0.79
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.11
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 5.11 | 4.9733 | 7700.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 7700.0 | nM | 5.11 | Antimalarial activity against chloroquine-sensitive Plasmodium falciparum 3D7 af... | 29533611 |
| Plasmodium falciparum | IC50 | = | 8900.0 | nM | 5.05 | Antiplasmodial activity against choloroquine-sensitive ring stage of Plasmodium ... | 38416027 |
| Plasmodium falciparum | IC50 | = | 17200.0 | nM | 4.76 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum Dd2 af... | 29533611 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29533611 | 10.1021/acs.jnatprod.7b00992 | Unchecked | 2 |
| 29533611 | 10.1021/acs.jnatprod.7b00992 | Plasmodium falciparum | 2 |
| 29533611 | 10.1021/acs.jnatprod.7b00992 | HEK293 | 1 |
| 38416027 | 10.1021/acs.jnatprod.3c01072 | Plasmodium falciparum | 1 |
| 38416027 | 10.1021/acs.jnatprod.3c01072 | HEK293 | 1 |
Data from ChEMBL 36 via Core Engine