Compound Detail
CHEMBL4218778
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Basic Information
| ChEMBL ID | CHEMBL4218778 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZLFNBWJQXSVCLW-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
304.3
MW (Da)
2.28
ALogP
6
HBA
1
HBD
94.7
PSA (Ų)
0.65
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| rhinovirus B14 CHEMBL613759 | EC50 | 5.7 | 5.7 | 2000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| rhinovirus B14 | EC50 | = | 2000.0 | nM | 5.7 | Antiviral activity against Human rhinovirus B14 infected in human HeLa Rh cells ... | 28987610 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28987610 | 10.1016/j.ejmech.2017.09.036 | Unchecked | 2 |
| 28987610 | 10.1016/j.ejmech.2017.09.036 | rhinovirus B14 | 1 |
Data from ChEMBL 36 via Core Engine