Compound Detail
CHEMBL3144012
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Basic Information
| ChEMBL ID | CHEMBL3144012 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DIQKJLLWWOYCKY-LFAOKBQASA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
298.3
MW (Da)
-0.77
ALogP
8
HBA
4
HBD
124.4
PSA (Ų)
0.43
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 8.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Influenza A virus CHEMBL613740 | IC50 | 8.0 | 8.0 | 10.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Influenza A virus | IC50 | = | 10.0 | nM | 8.0 | Antiviral activity against Influenza A virus A/WSN/33(H1N1) infected in dog MDCK... | 35092894 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7143371 | 10.1021/jm00353a012 | Vero | 3 |
| 2539476 | 10.1021/jm00124a005 | Human respirovirus 3 | 1 |
| 2539476 | 10.1021/jm00124a005 | Human rhinovirus 1A | 1 |
| 2539476 | 10.1021/jm00124a005 | Human alphaherpesvirus 2 | 1 |
| 2539476 | 10.1021/jm00124a005 | Human adenovirus 2 | 1 |
| 35092894 | 10.1016/j.bmc.2022.116613 | Influenza A virus | 1 |
| 35092894 | 10.1016/j.bmc.2022.116613 | MDCK | 1 |
Data from ChEMBL 36 via Core Engine