Compound Detail
CHEMBL4470169
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Basic Information
| ChEMBL ID | CHEMBL4470169 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QNLFWSBEKMYNFI-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
466.6
MW (Da)
1.96
ALogP
7
HBA
2
HBD
107.5
PSA (Ų)
0.55
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.02
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Trypanosoma cruzi CHEMBL368 | IC50 | 4.02 | 4.02 | 96000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Trypanosoma cruzi | IC50 | = | 96000.0 | nM | 4.02 | Antitrypanosomal activity against Trypanosoma cruzi Tulahuen C4 trypomastigotes ... | 31706668 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31706668 | 10.1016/j.bmcl.2019.126778 | Trypanosoma cruzi | 1 |
Data from ChEMBL 36 via Core Engine