Compound Detail
CHEMBL121690
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 | CHEMBL121690 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZADISRFYMTWQNC-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
239.2
MW (Da)
-1.26
ALogP
8
HBA
3
HBD
119.3
PSA (Ų)
0.60
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.46
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cowpox virus CHEMBL612672 | EC50 | 5.46 | 5.46 | 3500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cowpox virus | EC50 | = | 3500.0 | nM | 5.46 | Antiviral activity against Cowpox virus infected in Vero cells measured after 4 ... | 36961984 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3871860 | 10.1021/jm00381a015 | Vero | 1 |
| 36961984 | 10.1021/acs.jmedchem.3c00069 | Cowpox virus | 1 |
Data from ChEMBL 36 via Core Engine