Compound Detail
CHEMBL513182
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Basic Information
| ChEMBL ID | CHEMBL513182 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ODLGMSQBFONGNG-JXOAFFINSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
284.2
MW (Da)
-1.93
ALogP
9
HBA
4
HBD
179.6
PSA (Ų)
0.28
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.56
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatitis C virus CHEMBL379 | IC50 | 4.56 | 4.56 | 27800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatitis C virus | IC50 | = | 27800.0 | nM | 4.56 | Antiviral activity against Hepatitis C virus infected human 2209-23 cells by gen... | 19055482 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19055482 | 10.1021/jm800981y | Hepatitis C virus | 1 |
| 19055482 | 10.1021/jm800981y | ADMET | 1 |
| 19055482 | 10.1021/jm800981y | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine