Compound Detail
CHEMBL507466
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Basic Information
| ChEMBL ID | CHEMBL507466 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IEZIVWKSRCGZJP-UHFFFAOYSA-N |
2
Targets
5
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
354.9
MW (Da)
5.06
ALogP
4
HBA
2
HBD
54.2
PSA (Ų)
0.61
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 7.79
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.79 | 7.6733 | 16.3 | 3 |
| Plasmodium berghei CHEMBL612653 | IC50 | 7.74 | 7.74 | 18.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 16.3 | nM | 7.79 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum Thai a... | 17485145 |
| Plasmodium falciparum | IC50 | = | 18.1 | nM | 7.74 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum FcB1R ... | 17485145 |
| Plasmodium berghei | IC50 | = | 18.1 | nM | 7.74 | Antiplasmodial activity against Plasmodium berghei infected in perorally dosed m... | 20466465 |
| Plasmodium falciparum | IC50 | = | 32.3 | nM | 7.49 | Antimalarial activity against chloroquine-resistant Plasmodium falciparum K1 aft... | 17485145 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17485145 | 10.1016/j.ejmech.2007.03.008 | Plasmodium berghei | 4 |
| 17485145 | 10.1016/j.ejmech.2007.03.008 | Plasmodium falciparum | 3 |
| 17485145 | 10.1016/j.ejmech.2007.03.008 | Unchecked | 2 |
| 17485145 | 10.1016/j.ejmech.2007.03.008 | ADMET | 1 |
| 20466465 | 10.1016/j.ejmech.2010.04.011 | Plasmodium berghei | 1 |
Data from ChEMBL 36 via Core Engine