Compound Detail
CHEMBL4452511
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 | CHEMBL4452511 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OHKZIWBLGBEUQY-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
484.6
MW (Da)
4.37
ALogP
8
HBA
2
HBD
117.2
PSA (Ų)
0.40
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 8.05
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus 1 CHEMBL378 | EC50 | 8.05 | 8.05 | 8.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus 1 | EC50 | = | 8.95 | nM | 8.05 | Antiviral activity against HIV1 NL4-3 infected in human TZM-bl cells after 2 day... | 30624934 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30624934 | 10.1021/acs.jmedchem.8b01656 | TZM | 1 |
| 30624934 | 10.1021/acs.jmedchem.8b01656 | Human immunodeficiency virus 1 | 1 |
| 30624934 | 10.1021/acs.jmedchem.8b01656 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine