Compound Detail
CHEMBL3143049
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Basic Information
| ChEMBL ID | CHEMBL3143049 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YSAKIJWBMZQQHD-BFHYXJOUSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
318.3
MW (Da)
0.59
ALogP
7
HBA
2
HBD
97.7
PSA (Ų)
0.62
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 5.1
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human alphaherpesvirus 3 CHEMBL613132 | EC50 | 5.1 | 5.05 | 8000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human alphaherpesvirus 3 | EC50 | = | 8000.0 | nM | 5.1 | Effective concentration required for reduction of plaque formation of Varicella-... | 11212118 |
| Human alphaherpesvirus 3 | EC50 | = | 10000.0 | nM | 5.0 | Effective concentration required for reduction of plaque formation of Varicella-... | 11212118 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11212118 | 10.1016/s0960-894x(00)00672-7 | Human alphaherpesvirus 3 | 4 |
| 11212118 | 10.1016/s0960-894x(00)00672-7 | HEL | 2 |
| 11212118 | 10.1016/s0960-894x(00)00672-7 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine