Compound Detail
CHEMBL3431266
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 | CHEMBL3431266 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MPENUCBKXGZRPD-UHFFFAOYSA-N |
5
Targets
9
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
350.4
MW (Da)
4.33
ALogP
5
HBA
1
HBD
58.0
PSA (Ų)
0.54
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 9 meas. best 7.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Trypanosoma cruzi CHEMBL368 | IC50 | 7.7 | 7.4667 | 19.9 | 3 |
| Sterol 14-alpha demethylase CHEMBL1075110 | IC50 | 7.1 | 7.1 | 79.4 | 1 |
| Leishmania donovani CHEMBL367 | IC50 | 5.9 | 5.0333 | 1258.9 | 3 |
| Trypanosoma brucei brucei CHEMBL612851 | IC50 | 4.6 | 4.6 | 25118.9 | 1 |
| NIH3T3 CHEMBL614822 | IC50 | 4.5 | 4.5 | 31622.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.6019/CHEMBL3430912 | Trypanosoma cruzi | 4 |
| - | 10.6019/CHEMBL3430912 | Leishmania donovani | 4 |
| - | 10.6019/CHEMBL3430912 | Trypanosoma brucei brucei | 1 |
| - | 10.6019/CHEMBL3430912 | HepG2 | 1 |
| - | 10.6019/CHEMBL3430912 | NIH3T3 | 1 |
| - | 10.6019/CHEMBL3430912 | Sterol 14-alpha demethylase | 1 |
Data from ChEMBL 36 via Core Engine