Compound Detail
CHEMBL4845727
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Basic Information
| ChEMBL ID | CHEMBL4845727 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HKTUKYTYOQTZAX-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
402.5
MW (Da)
4.51
ALogP
4
HBA
1
HBD
64.2
PSA (Ų)
0.66
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human orthopneumovirus CHEMBL613127 | EC50 | 6.62 | 6.62 | 240.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human orthopneumovirus | EC50 | = | 240.0 | nM | 6.62 | Antiviral activity against Respiratory syncytial virus A2 infected in African gr... | 33729773 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33729773 | 10.1021/acs.jmedchem.0c01882 | Human orthopneumovirus | 1 |
| 33729773 | 10.1021/acs.jmedchem.0c01882 | Vero | 1 |
Data from ChEMBL 36 via Core Engine