Compound Detail
CHEMBL441175
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Basic Information
| ChEMBL ID | CHEMBL441175 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RAGVUCIHXGJGEQ-YLXLXVFQSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
262.4
MW (Da)
0.62
ALogP
3
HBA
1
HBD
43.8
PSA (Ų)
0.70
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Influenza A virus CHEMBL613740 | IC50 | 4.07 | 4.07 | 84700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Influenza A virus | IC50 | = | 84700.0 | nM | 4.07 | Antiviral activity against influenza A virus (A/Hanfang/359/95(H3N2)) infected i... | 26132528 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16364643 | 10.1016/j.bmcl.2005.11.073 | Hepatitis B virus | 4 |
| 16364643 | 10.1016/j.bmcl.2005.11.073 | HepG2 | 1 |
| 26132528 | 10.1021/acs.jnatprod.5b00325 | Unchecked | 1 |
| 26132528 | 10.1021/acs.jnatprod.5b00325 | Coxsackievirus B3 | 1 |
| 26132528 | 10.1021/acs.jnatprod.5b00325 | MDCK | 1 |
| 26132528 | 10.1021/acs.jnatprod.5b00325 | Influenza A virus | 1 |
Data from ChEMBL 36 via Core Engine