Compound Detail
CHEMBL490821
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Basic Information
| ChEMBL ID | CHEMBL490821 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ADZDQOZVSUYRGT-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
314.7
MW (Da)
3.57
ALogP
5
HBA
0
HBD
61.2
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.97
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| SARS-CoV CHEMBL4303836 | IC50 | 5.97 | 5.97 | 1080.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| SARS-CoV | IC50 | = | 1080.0 | nM | 5.97 | Antiviral activity against SARS-CoV Urbani in african green monkey Vero E6 cells... | 18796354 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18796354 | 10.1016/j.bmcl.2008.08.082 | SARS-CoV | 1 |
| 18796354 | 10.1016/j.bmcl.2008.08.082 | Replicase polyprotein 1a | 1 |
Data from ChEMBL 36 via Core Engine