Compound Detail
CHEMBL342343
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL342343 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KIEVPIBIYKKJRJ-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
7
Publications
0
Known Names
Molecular Properties
252.3
MW (Da)
3.47
ALogP
3
HBA
0
HBD
39.4
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.9
IC50 1 meas. best 4.97
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Influenza A virus CHEMBL613740 | EC50 | 7.9 | 7.9 | 12.6 | 1 |
| Neuraminidase CHEMBL2051 | IC50 | 4.97 | 4.97 | 10760.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Influenza A virus | EC50 | = | 12.57 | nM | 7.9 | Antiviral activity against Influenza A virus (H1N1) infected in dog MDCK cells a... | 31744778 |
| Neuraminidase | IC50 | = | 10760.0 | nM | 4.97 | Inhibition of Influenza A virus (H1N1) neuraminidase | 31744778 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28408221 | 10.1016/j.bmcl.2017.03.057 | RAW264.7 | 2 |
| 8523407 | 10.1021/jm00025a011 | Rattus norvegicus | 1 |
| 18158201 | 10.1016/j.ejmech.2007.11.009 | Unchecked | 1 |
| 31744778 | 10.1016/j.bmc.2019.115191 | MDCK | 1 |
| 31744778 | 10.1016/j.bmc.2019.115191 | Influenza A virus | 1 |
| 31744778 | 10.1016/j.bmc.2019.115191 | Unchecked | 1 |
| 31744778 | 10.1016/j.bmc.2019.115191 | Neuraminidase | 1 |
Data from ChEMBL 36 via Core Engine