Compound Detail
CHEMBL125510
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 | CHEMBL125510 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RJDHCISUIBFLAH-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
293.4
MW (Da)
3.82
ALogP
4
HBA
2
HBD
58.0
PSA (Ų)
0.77
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus type 1 reverse transcriptase CHEMBL247 | IC50 | 6.47 | 6.47 | 335.0 | 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 | = | 338.84 | nM | 6.47 | Inhibition of HIV-1 reverse transcriptase (HIV-1 RT) | 8831772 |
| Human immunodeficiency virus type 1 reverse transcriptase | IC50 | = | 335.0 | nM | 6.47 | In vitro HIV-1 RT inhibitory activity using rC.dG as template-primer | 1279173 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 8831772 | 10.1021/jm960058h | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
| 1279173 | 10.1021/jm00099a007 | Human immunodeficiency virus type 1 reverse transcriptase | 1 |
Data from ChEMBL 36 via Core Engine