Compound Detail
CHEMBL1922283
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Basic Information
| ChEMBL ID | CHEMBL1922283 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BNILZSJXXDACBM-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
341.2
MW (Da)
4.05
ALogP
4
HBA
1
HBD
60.5
PSA (Ų)
0.89
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.78
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.78 | 4.625 | 16500.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 16500.0 | nM | 4.78 | Inhibition of His-tagged catalytic domain Trypanosoma brucei brucei PDEB1 expres... | 22023548 |
| Unchecked | IC50 | = | 34000.0 | nM | 4.47 | Inhibition of His-tagged catalytic domain Trypanosoma brucei brucei PDEB2 expres... | 22023548 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22023548 | 10.1021/jm201148s | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine