Compound Detail
CHEMBL2079794
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Basic Information
| ChEMBL ID | CHEMBL2079794 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ASJMAYMGRVZHNB-UHFFFAOYSA-M |
| Parent Compound | CHEMBL1240618 |
| Active Moiety | CHEMBL1240618 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
298.4
MW (Da)
1.50
ALogP
6
HBA
2
HBD
96.4
PSA (Ų)
0.89
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Hepatitis C virus CHEMBL379 | EC50 | 5.82 | 5.82 | 1500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Hepatitis C virus | EC50 | = | 1500.0 | nM | 5.82 | Antiviral activity against HCV genotype 1b infected in Ava5 cells assessed as in... | 22059983 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22059983 | 10.1021/jm201264t | Hepatitis C virus | 2 |
| 22059983 | 10.1021/jm201264t | Unchecked | 1 |
| 22059983 | 10.1021/jm201264t | ADMET | 1 |
Data from ChEMBL 36 via Core Engine