Compound Detail
CHEMBL49161
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Basic Information
| ChEMBL ID | CHEMBL49161 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XFGFZYQHYXFFQT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
366.3
MW (Da)
2.87
ALogP
7
HBA
0
HBD
90.0
PSA (Ų)
0.52
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.89
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human rhinovirus sp. CHEMBL612470 | IC50 | 6.89 | 6.89 | 130.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human rhinovirus sp. | IC50 | = | 130.0 | nM | 6.89 | Antiviral activity against rhinoviral-1B serotype in a plaque inhibition assay u... | 2547069 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2547069 | 10.1021/jm00128a016 | Human rhinovirus sp. | 1 |
Data from ChEMBL 36 via Core Engine