Compound Detail
CHEMBL288000
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Basic Information
| ChEMBL ID | CHEMBL288000 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YGKHJMBSOQFAIN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
393.3
MW (Da)
5.16
ALogP
4
HBA
0
HBD
36.9
PSA (Ų)
0.61
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Trypanosoma cruzi CHEMBL368 | IC50 | 4.07 | 4.07 | 85000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Trypanosoma cruzi | IC50 | = | 85000.0 | nM | 4.07 | Concentration required to inhibit proliferation of the epimastigote form of Tryp... | 9554887 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9554887 | 10.1021/jm970860z | Trypanosoma cruzi | 1 |
Data from ChEMBL 36 via Core Engine