Compound Detail
CHEMBL363717
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Basic Information
| ChEMBL ID | CHEMBL363717 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IVFDJKKIVGVFBJ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
364.5
MW (Da)
3.53
ALogP
2
HBA
4
HBD
100.8
PSA (Ų)
0.42
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.45
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 7.45 | 7.45 | 35.7 | 1 |
| Trypanosoma brucei rhodesiense CHEMBL612348 | IC50 | 7.39 | 7.39 | 40.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 35.7 | nM | 7.45 | In vitro antiprotozoal activity for Plasmodium falciparum K1 | 16107146 |
| Trypanosoma brucei rhodesiense | IC50 | = | 40.4 | nM | 7.39 | In vitro antiprotozoal activity against Trypanosoma brucei rhodesiense strain ST... | 16107146 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16107146 | 10.1021/jm058190h | Mus musculus | 2 |
| 16107146 | 10.1021/jm058190h | Trypanosoma brucei rhodesiense | 1 |
| 16107146 | 10.1021/jm058190h | Plasmodium falciparum | 1 |
| 16107146 | 10.1021/jm058190h | L6 | 1 |
| 16107146 | 10.1021/jm058190h | Nucleic Acid | 1 |
Data from ChEMBL 36 via Core Engine