Compound Detail
CHEMBL3142406
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL3142406 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VECLHVVFVIYQMM-GVDBMIGSSA-N |
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
380.5
MW (Da)
3.00
ALogP
7
HBA
2
HBD
84.6
PSA (Ų)
0.65
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 8.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human alphaherpesvirus 3 CHEMBL613132 | EC50 | 8.7 | 8.5 | 2.0 | 2 |
| HEL CHEMBL613888 | EC50 | 8.7 | 8.5 | 2.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human alphaherpesvirus 3 | EC50 | = | 2.0 | nM | 8.7 | Antiviral activity against Varicella-Zoster virus (OKA) | 15109620 |
| HEL | EC50 | = | 2.0 | nM | 8.7 | Antiviral activity was measured as effective concentration required to reduce Va... | 11549457 |
| Human alphaherpesvirus 3 | EC50 | = | 5.0 | nM | 8.3 | Antiviral activity against Varicella-Zoster virus (YS) | 15109620 |
| HEL | EC50 | = | 5.0 | nM | 8.3 | Antiviral activity was measured as effective concentration required to reduce Va... | 11549457 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11549457 | 10.1016/s0960-894x(01)00471-1 | HEL | 6 |
| 15109620 | 10.1016/j.bmcl.2004.03.029 | Human alphaherpesvirus 3 | 3 |
| 15109620 | 10.1016/j.bmcl.2004.03.029 | HeLa | 2 |
Data from ChEMBL 36 via Core Engine