Compound Detail
CHEMBL1495736
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Basic Information
| ChEMBL ID | CHEMBL1495736 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DWDDBDJWOXJEMQ-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
409.5
MW (Da)
3.64
ALogP
4
HBA
1
HBD
79.4
PSA (Ų)
0.71
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.3
IC50 1 meas. best 5.73
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.73 | 5.73 | 1860.0 | 1 |
| Respiratory syncytial virus CHEMBL612679 | EC50 | 5.3 | 5.3 | 5000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 1860.0 | nM | 5.73 | PUBCHEM_BIOASSAY: A Cell Based HTS Approach for the Discovery of New Inhibitors ... | - |
| Respiratory syncytial virus | EC50 | = | 5000.0 | nM | 5.3 | Antiviral activity against Respiratory syncytial virus Long infected in human He... | 23043370 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23043370 | 10.1021/jm300612z | Respiratory syncytial virus | 2 |
| 23043370 | 10.1021/jm300612z | Unchecked | 1 |
| 23043370 | 10.1021/jm300612z | HEp-2 | 1 |
Data from ChEMBL 36 via Core Engine