Compound Detail
CHEMBL287845
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Basic Information
| ChEMBL ID | CHEMBL287845 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IWVFFRUDPUZDMN-UHFFFAOYSA-N |
1
Targets
2
Activities
2
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
233.2
MW (Da)
-1.71
ALogP
7
HBA
3
HBD
110.6
PSA (Ų)
0.56
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas.
IC50 1 meas. best 4.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cytomegalovirus CHEMBL613134 | IC50 | 4.85 | 4.85 | 14000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cytomegalovirus | IC50 | = | 14000.0 | nM | 4.85 | Inhibition of growth of human cytomegalovirus (HCMV) was determined by plaque re... | 2826784 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16759112 | 10.1021/jm060102l | Hepatitis B virus | 3 |
| 16759112 | 10.1021/jm060102l | Duck hepatitis B virus | 2 |
| 2826784 | 10.1021/jm00396a021 | Cytomegalovirus | 1 |
| 2826784 | 10.1021/jm00396a021 | Human gammaherpesvirus 4 | 1 |
| 3871860 | 10.1021/jm00381a015 | Vero | 1 |
| 16759112 | 10.1021/jm060102l | HepG2 | 1 |
| 16759112 | 10.1021/jm060102l | Vero | 1 |
| 16759112 | 10.1021/jm060102l | Hepatitis C virus | 1 |
Data from ChEMBL 36 via Core Engine