Compound Detail
CHEMBL179673
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Basic Information
| ChEMBL ID | CHEMBL179673 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SXCZQGQKPFLBQR-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
418.5
MW (Da)
5.45
ALogP
3
HBA
1
HBD
62.5
PSA (Ų)
0.60
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 9.3
IC50 1 meas. best 7.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RNA-directed RNA polymerase CHEMBL4296320 | EC50 | 9.3 | 9.3 | 0.5 | 1 |
| RNA-directed RNA polymerase CHEMBL4296320 | IC50 | 7.77 | 7.77 | 17.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RNA-directed RNA polymerase | EC50 | = | 0.5 | nM | 9.3 | Effective concentration to inhibit the activity of RNA dependent RNA polymerase ... | 15743173 |
| RNA-directed RNA polymerase | IC50 | = | 17.0 | nM | 7.77 | Inhibitory activity against RNA dependent RNA polymerase nonstructural protein 5... | 15743173 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15743173 | 10.1021/jm049122i | RNA-directed RNA polymerase | 2 |
| 15743173 | 10.1021/jm049122i | Hepatitis C virus | 1 |
Data from ChEMBL 36 via Core Engine