Compound Detail
CHEMBL201494
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 | CHEMBL201494 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GJUICISFOWLPAP-IPMKNSEASA-N |
2
Targets
5
Activities
2
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
388.5
MW (Da)
2.73
ALogP
7
HBA
2
HBD
97.7
PSA (Ų)
0.53
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 4 meas. best 5.57
IC50 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human alphaherpesvirus 3 CHEMBL613132 | EC50 | 5.57 | 5.38 | 2700.0 | 2 |
| Human betaherpesvirus 5 CHEMBL371 | EC50 | 5.13 | 5.125 | 7400.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human alphaherpesvirus 3 | EC50 | = | 2700.0 | nM | 5.57 | Antiviral activity against Varicella-Zoster virus YS strain | 16392824 |
| Human alphaherpesvirus 3 | EC50 | = | 6500.0 | nM | 5.19 | Antiviral activity against Varicella-Zoster virus YS/R strain | 16392824 |
| Human betaherpesvirus 5 | EC50 | = | 7400.0 | nM | 5.13 | Antiviral activity against human cytomegalovirus AD169 strain | 16392824 |
| Human betaherpesvirus 5 | EC50 | = | 7600.0 | nM | 5.12 | Antiviral activity against human cytomegalovirus Davis strain | 16392824 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16392824 | 10.1021/jm050867d | Human alphaherpesvirus 3 | 3 |
| 16392824 | 10.1021/jm050867d | Human betaherpesvirus 5 | 2 |
| 16392824 | 10.1021/jm050867d | HEL | 2 |
| 17622128 | 10.1021/jm070210n | Thymidine kinase | 1 |
Data from ChEMBL 36 via Core Engine