Compound Detail
CHEMBL291054
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Basic Information
| ChEMBL ID | CHEMBL291054 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VFSZKXSSCLAMNZ-UHFFFAOYSA-N |
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
270.2
MW (Da)
2.27
ALogP
5
HBA
0
HBD
73.6
PSA (Ų)
0.67
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.31
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Trypanosoma cruzi CHEMBL368 | IC50 | 6.31 | 6.2767 | 490.0 | 3 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Trypanosoma cruzi | IC50 | = | 490.0 | nM | 6.31 | In vitro for antitrypanosomal activity against Trypanosoma cruzi epimastigote, Y... | - |
| Trypanosoma cruzi | IC50 | = | 530.0 | nM | 6.28 | In vitro antitrypanosomal activity against Trypanosoma cruzi epimastigote, CL st... | - |
| Trypanosoma cruzi | IC50 | = | 570.0 | nM | 6.24 | In vitro for antitrypanosomal activity against Trypanosoma cruzi epimastigote, S... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(95)00248-R | Trypanosoma cruzi | 4 |
Data from ChEMBL 36 via Core Engine