Compound Detail
CHEMBL593072
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Basic Information
| ChEMBL ID | CHEMBL593072 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JUIICGOBLLBOTJ-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1198007 |
| Active Moiety | CHEMBL1198007 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
133.2
MW (Da)
0.99
ALogP
0
HBA
1
HBD
19.7
PSA (Ų)
0.52
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 4.72 | 4.72 | 19000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 19000.0 | nM | 4.72 | Antimalarial activity against chloroquine and pyrimethamine-resistant Plasmodium... | 19781948 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19781948 | 10.1016/j.bmc.2009.08.057 | Plasmodium falciparum | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | Trypanosoma cruzi | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | Leishmania donovani | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | Unchecked | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | Trypanosoma brucei rhodesiense | 1 |
| 19781948 | 10.1016/j.bmc.2009.08.057 | L6 | 1 |
Data from ChEMBL 36 via Core Engine