Compound Detail
CHEMBL4784657
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 | CHEMBL4784657 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PKNDIPJUXQNRHO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
398.9
MW (Da)
5.87
ALogP
3
HBA
1
HBD
43.3
PSA (Ų)
0.43
QED
1
Ro5 Violations
10
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.71
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus 1 CHEMBL378 | EC50 | 5.71 | 5.71 | 1950.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus 1 | EC50 | = | 1950.0 | nM | 5.71 | Antiviral activity against VSVG/wild-type HIV-1 infected in human HEK 293T cells... | 32004936 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 32004936 | 10.1016/j.ejmech.2020.112071 | Human immunodeficiency virus 1 | 1 |
| 32004936 | 10.1016/j.ejmech.2020.112071 | HEK-293T | 1 |
| 32004936 | 10.1016/j.ejmech.2020.112071 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine