Compound Detail
CHEMBL438246
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Basic Information
| ChEMBL ID | CHEMBL438246 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XKKWGAIJWNCAQR-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
9
Publications
0
Known Names
Molecular Properties
352.4
MW (Da)
3.08
ALogP
7
HBA
0
HBD
90.0
PSA (Ų)
0.50
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.77
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| HFF CHEMBL614071 | IC50 | 6.77 | 6.77 | 170.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| HFF | IC50 | = | 170.0 | nM | 6.77 | Antiviral activity against human CMV by luciferase reporter gene assay in HFF ce... | 16814545 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16814545 | 10.1016/j.bmcl.2006.06.066 | HFF | 1 |
| 16814545 | 10.1016/j.bmcl.2006.06.066 | Human alphaherpesvirus 1 | 1 |
| 16814545 | 10.1016/j.bmcl.2006.06.066 | Human gammaherpesvirus 4 | 1 |
| 16814545 | 10.1016/j.bmcl.2006.06.066 | Human immunodeficiency virus | 1 |
| 16814545 | 10.1016/j.bmcl.2006.06.066 | Human betaherpesvirus 6 | 1 |
| 16814545 | 10.1016/j.bmcl.2006.06.066 | Murid betaherpesvirus 2 | 1 |
| 16814545 | 10.1016/j.bmcl.2006.06.066 | Caviid betaherpesvirus 2 | 1 |
| 16814545 | 10.1016/j.bmcl.2006.06.066 | Murid betaherpesvirus 1 | 1 |
| 16814545 | 10.1016/j.bmcl.2006.06.066 | NON-PROTEIN TARGET | 1 |
Data from ChEMBL 36 via Core Engine