Compound Detail
CHEMBL2040641
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Basic Information
| ChEMBL ID | CHEMBL2040641 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OFOKTIUODIQWHZ-TWGQIWQCSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
198.2
MW (Da)
1.66
ALogP
3
HBA
2
HBD
74.6
PSA (Ų)
0.53
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 4.53
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Polymerase acidic protein CHEMBL1169598 | IC50 | 4.53 | 4.53 | 29400.0 | 2 |
| Influenza A virus CHEMBL613740 | IC50 | 4.53 | 4.53 | 29400.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Polymerase acidic protein | IC50 | = | 29400.0 | nM | 4.53 | Inhibitory concentration against cap-dependent endonuclease activity of influenz... | 12646026 |
| Polymerase acidic protein | IC50 | = | 29400.0 | nM | 4.53 | Inhibition of cap 1 ALMV primed Influenza transcriptase | 7695269 |
| Influenza A virus | IC50 | = | 29400.0 | nM | 4.53 | Antiviral activity against Influenza A virus A/PR/8/34 (PR8) strain infected in ... | 34591488 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 12646026 | 10.1021/jm020334u | Polymerase acidic protein | 1 |
| 7695269 | 10.1128/aac.38.12.2827 | Polymerase acidic protein | 1 |
| 34591488 | 10.1021/acs.jmedchem.1c01215 | Influenza A virus | 1 |
Data from ChEMBL 36 via Core Engine