Compound Detail
CHEMBL55024
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Basic Information
| ChEMBL ID | CHEMBL55024 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WMCUHWFIGJEXHZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
338.4
MW (Da)
4.94
ALogP
3
HBA
1
HBD
50.4
PSA (Ų)
0.86
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.43
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human rhinovirus A protease CHEMBL2857 | Ki | 7.43 | 7.43 | 37.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human rhinovirus A protease | Ki | = | 37.0 | nM | 7.43 | Binding affinity against HIV protease | 7783120 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7783120 | 10.1021/jm00011a008 | Human rhinovirus A protease | 2 |
Data from ChEMBL 36 via Core Engine