Compound Detail
CHEMBL73007
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Basic Information
| ChEMBL ID | CHEMBL73007 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IFRMECQLFGLWCS-YRNVUSSQSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
225.3
MW (Da)
2.45
ALogP
4
HBA
1
HBD
37.6
PSA (Ų)
0.36
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Trypanosoma brucei CHEMBL612849 | IC50 | 6.52 | 6.52 | 300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Trypanosoma brucei | IC50 | = | 300.0 | nM | 6.52 | Antitrypanosomal activity against Trypanosoma brucei | 23611656 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11055329 | 10.1016/s0960-894x(00)00446-7 | Entamoeba histolytica | 1 |
| 15163200 | 10.1021/jm030549j | Rhodesain | 1 |
| 15163200 | 10.1021/jm030549j | Trypanosoma brucei rhodesiense | 1 |
| 15163200 | 10.1021/jm030549j | Falcipain 2 | 1 |
| 15163200 | 10.1021/jm030549j | Plasmodium falciparum | 1 |
| 23611656 | 10.1021/jm301424d | Unchecked | 1 |
| 23611656 | 10.1021/jm301424d | Trypanosoma brucei | 1 |
| 29259741 | 10.1021/acsmedchemlett.7b00313 | Cystathionine gamma-lyase | 1 |
Data from ChEMBL 36 via Core Engine