Compound Detail
CHEMBL85446
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 | CHEMBL85446 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FQVDJZWFSZSGGA-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
281.4
MW (Da)
3.40
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.80
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 reverse transcriptase CHEMBL247 | IC50 | 7.52 | 7.49 | 30.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 reverse transcriptase | IC50 | = | 30.0 | nM | 7.52 | In vitro for inhibitory activity against HIV-1 Reverse Transcriptase | 7681480 |
| Human immunodeficiency virus type 1 reverse transcriptase | IC50 | = | 35.0 | nM | 7.46 | Inhibitory activity against HIV-1 reverse transcriptase (HIV-RT) | 7689109 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7681480 | 10.1021/jm00058a009 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
| 7689109 | 10.1021/jm00069a011 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
Data from ChEMBL 36 via Core Engine