Compound Detail
CHEMBL174719
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Basic Information
| ChEMBL ID | CHEMBL174719 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MBPDJQVPBGATFL-APSNUPSMSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
392.2
MW (Da)
4.00
ALogP
5
HBA
2
HBD
107.6
PSA (Ų)
0.44
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 7.35
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RNA-directed RNA polymerase CHEMBL4296320 | IC50 | 7.35 | 7.35 | 45.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RNA-directed RNA polymerase | IC50 | = | 45.0 | nM | 7.35 | Inhibitory activity against Hepatitis C virus RNA dependent RNA polymerase nonst... | 14695815 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14695815 | 10.1021/jm0342109 | Nucleic Acid | 3 |
| 14695815 | 10.1021/jm0342109 | RNA-directed RNA polymerase | 1 |
| 14695815 | 10.1021/jm0342109 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
Data from ChEMBL 36 via Core Engine