Compound Detail
CHEMBL70936
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 | CHEMBL70936 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QJOALQNGCCOIRS-NILFDRSVSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
365.4
MW (Da)
0.90
ALogP
7
HBA
3
HBD
132.4
PSA (Ų)
0.62
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuraminidase CHEMBL2051 | IC50 | 6.48 | 6.48 | 330.0 | 1 |
| Neuraminidase CHEMBL3377 | IC50 | 4.89 | 4.89 | 13000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuraminidase | IC50 | = | 330.0 | nM | 6.48 | Inhibitory activity against influenza A virus sialidase | - |
| Neuraminidase | IC50 | = | 13000.0 | nM | 4.89 | Inhibitory activity against influenza B virus sialidase | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/S0960-894X(97)00399-5 | Neuraminidase | 2 |
Data from ChEMBL 36 via Core Engine