Compound Detail
CHEMBL3593879
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 | CHEMBL3593879 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MNLXHIDGYZNUAR-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
424.9
MW (Da)
5.14
ALogP
6
HBA
1
HBD
87.9
PSA (Ų)
0.43
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Human immunodeficiency virus 1 CHEMBL378 | EC50 | 5.41 | 5.41 | 3900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Human immunodeficiency virus 1 | EC50 | = | 3900.0 | nM | 5.41 | Antiviral activity against HIV1 3B infected in human MT4 cells assessed as inhib... | 26162497 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26162497 | 10.1016/j.bmc.2015.06.048 | Human immunodeficiency virus 1 | 2 |
| 26162497 | 10.1016/j.bmc.2015.06.048 | Human immunodeficiency virus 2 | 1 |
| 26162497 | 10.1016/j.bmc.2015.06.048 | MT4 | 1 |
| 26162497 | 10.1016/j.bmc.2015.06.048 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine