Compound Detail
CHEMBL5435791
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 | CHEMBL5435791 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VSSRMWVDISOANM-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
365.4
MW (Da)
5.55
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.71
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| H9c2 CHEMBL614576 | IC50 | 4.8 | 4.8 | 15848.9 | 1 |
| Trypanosoma cruzi CHEMBL368 | IC50 | 4.7 | 4.7 | 19952.6 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| H9c2 | IC50 | = | 15848.93 | nM | 4.8 | Cytotoxicity against rat H9c2 cells assessed as reduction in cell viability meas... | 36626662 |
| Trypanosoma cruzi | IC50 | = | 19952.62 | nM | 4.7 | Antitrypanosomal activity against Trypanosoma cruzi Tulahuen trypomastigotes ass... | 36626662 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 36626662 | 10.1021/acs.jmedchem.2c01725 | H9c2 | 1 |
| 36626662 | 10.1021/acs.jmedchem.2c01725 | Trypanosoma cruzi | 1 |
Data from ChEMBL 36 via Core Engine