Compound Detail
CHEMBL2093922
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Basic Information
| ChEMBL ID | CHEMBL2093922 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PWFPFJATJGPVDV-HTXXDJJVSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
360.2
MW (Da)
2.80
ALogP
6
HBA
3
HBD
79.5
PSA (Ų)
0.78
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human betaherpesvirus 5 CHEMBL371 | IC50 | 5.0 | 5.0 | 10000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human betaherpesvirus 5 | IC50 | = | 10000.0 | nM | 5.0 | Antiviral activity assayed by ability to inhibit Towne strain of HCMV virus | 9575044 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9575044 | 10.1021/jm970545c | Human betaherpesvirus 5 | 2 |
| 9575044 | 10.1021/jm970545c | Homo sapiens | 1 |
Data from ChEMBL 36 via Core Engine