Compound Detail
CHEMBL1631359
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Basic Information
| ChEMBL ID | CHEMBL1631359 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BSNUROMRGPNVJY-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
356.9
MW (Da)
3.94
ALogP
5
HBA
1
HBD
41.0
PSA (Ų)
0.77
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 7.39
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dengue virus CHEMBL613757 | EC50 | 7.39 | 7.22 | 41.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dengue virus | EC50 | = | 41.0 | nM | 7.39 | Antiviral activity against 0.0001 MOI Dengue virus NGC infected in Cricetinae BH... | 19223625 |
| Dengue virus | EC50 | = | 90.0 | nM | 7.05 | Antiviral activity against Dengue virus NGC infected in human A549 cells assesse... | 19223625 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19223625 | 10.1128/aac.01148-08 | Dengue virus | 2 |
| 19223625 | 10.1128/aac.01148-08 | A549 | 1 |
Data from ChEMBL 36 via Core Engine