Compound Detail
CHEMBL368165
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 | CHEMBL368165 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | AGBVCIIPBONUFX-UHFFFAOYSA-N |
2
Targets
5
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
245.3
MW (Da)
3.73
ALogP
2
HBA
1
HBD
41.6
PSA (Ų)
0.55
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 4.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Trypanosoma cruzi CHEMBL368 | IC50 | 4.68 | 4.4267 | 20800.0 | 3 |
| Plasmodium falciparum CHEMBL364 | IC50 | 4.66 | 4.66 | 22100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Trypanosoma cruzi | IC50 | = | 20800.0 | nM | 4.68 | Antitrypanosomal activity against Trypanosoma cruzi amastigotes | 11300877 |
| Plasmodium falciparum | IC50 | = | 22100.0 | nM | 4.66 | Antiplasmodial activity against chloroquine-resistant Plasmodium falciparum K1 | 11300877 |
| Trypanosoma cruzi | IC50 | = | 49800.0 | nM | 4.3 | Antitrypanosomal activity against Trypanosoma cruzi epimastigotes | 11300877 |
| Trypanosoma cruzi | IC50 | = | 50000.0 | nM | 4.3 | Antitrypanosomal activity against (Trypanosoma cruzi) trypomastigotes (concentra... | 11300877 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11300877 | 10.1021/jm0010419 | Trypanosoma cruzi | 4 |
| 11300877 | 10.1021/jm0010419 | Plasmodium falciparum | 2 |
| 11300877 | 10.1021/jm0010419 | L6 | 1 |
Data from ChEMBL 36 via Core Engine