Compound Detail
CHEMBL4207075
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 | CHEMBL4207075 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HYNNXFWNAZOALE-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
338.4
MW (Da)
3.41
ALogP
6
HBA
1
HBD
90.1
PSA (Ų)
0.77
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 6.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | EC50 | 6.82 | 6.82 | 150.0 | 1 |
| rhinovirus A21 CHEMBL612371 | EC50 | 5.68 | 5.68 | 2100.0 | 1 |
| rhinovirus B14 CHEMBL613759 | EC50 | 4.89 | 4.89 | 12800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | EC50 | = | 150.0 | nM | 6.82 | Antiviral activity against Human rhinovirus A71 infected in human H1HeLa cells a... | 30034598 |
| rhinovirus A21 | EC50 | = | 2100.0 | nM | 5.68 | Antiviral activity against Human rhinovirus A21 infected in human H1HeLa cells a... | 30034598 |
| rhinovirus B14 | EC50 | = | 12800.0 | nM | 4.89 | Antiviral activity against Human rhinovirus B14 infected in human H1HeLa cells a... | 30034598 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30034598 | 10.1021/acsmedchemlett.8b00134 | H1-HeLa | 1 |
| 30034598 | 10.1021/acsmedchemlett.8b00134 | rhinovirus B14 | 1 |
| 30034598 | 10.1021/acsmedchemlett.8b00134 | rhinovirus A21 | 1 |
| 30034598 | 10.1021/acsmedchemlett.8b00134 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine