Compound Detail
CHEMBL328234
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Basic Information
| ChEMBL ID | CHEMBL328234 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CKMWSJFHRLRPBO-XDJHFCHBSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
362.3
MW (Da)
4.96
ALogP
2
HBA
2
HBD
36.8
PSA (Ų)
0.34
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.88
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Trypanosoma cruzi CHEMBL368 | IC50 | 4.88 | 4.88 | 13330.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Trypanosoma cruzi | IC50 | = | 13330.0 | nM | 4.88 | Antiparasitic activity against Trypanosoma cruzi Y strain trypomastigotes assess... | 27295485 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27295485 | 10.1016/j.ejmech.2016.05.050 | Cruzipain | 2 |
| 12061873 | 10.1021/jm010459j | Cruzipain | 1 |
| 27295485 | 10.1016/j.ejmech.2016.05.050 | Trypanosoma cruzi | 1 |
| 27295485 | 10.1016/j.ejmech.2016.05.050 | Splenocyte | 1 |
| 27295485 | 10.1016/j.ejmech.2016.05.050 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine