Compound Detail
CHEMBL4161893
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL4161893 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HICZTDSMQPYVDW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
283.1
MW (Da)
2.91
ALogP
4
HBA
0
HBD
65.3
PSA (Ų)
0.63
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Trypanosoma brucei brucei CHEMBL612851 | IC50 | 6.4 | 6.4 | 400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Trypanosoma brucei brucei | IC50 | = | 400.0 | nM | 6.4 | Antitrypanosomal activity against trypomastigote stage of Trypanosoma brucei bru... | 29885575 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29885575 | 10.1016/j.ejmech.2018.06.001 | No relevant target | 1 |
| 29885575 | 10.1016/j.ejmech.2018.06.001 | Leishmania infantum | 1 |
| 29885575 | 10.1016/j.ejmech.2018.06.001 | HepG2 | 1 |
| 29885575 | 10.1016/j.ejmech.2018.06.001 | Trypanosoma brucei brucei | 1 |
Data from ChEMBL 36 via Core Engine