Compound Detail
CHEMBL442634
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 | CHEMBL442634 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WPZTXMYFNWNBKC-FRRDWIJNSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
248.3
MW (Da)
-0.54
ALogP
5
HBA
3
HBD
87.7
PSA (Ų)
0.67
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 5.42 | 5.42 | 3800.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 3800.0 | nM | 5.42 | Inhibition of Trypanosoma vivax IAG-NH expressed in Escherichia coli WK6 cells | 18571422 |
| Unchecked | Ki | = | 3800.0 | nM | 5.42 | Inhibition of Trypanosoma vivax Inosine-adenosine-guanosine-nucleoside hydrolase | 20194690 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18571422 | 10.1016/j.bmc.2008.05.056 | Unchecked | 1 |
| 20194690 | 10.1128/aac.01787-09 | Unchecked | 1 |
| 20194690 | 10.1128/aac.01787-09 | Trypanosoma brucei brucei | 1 |
| 20194690 | 10.1128/aac.01787-09 | Trypanosoma cruzi | 1 |
| 20194690 | 10.1128/aac.01787-09 | Leishmania infantum | 1 |
| 20194690 | 10.1128/aac.01787-09 | Plasmodium falciparum | 1 |
Data from ChEMBL 36 via Core Engine