Compound Detail
CHEMBL3754330
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 | CHEMBL3754330 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YSQOKZBKPHHZPE-UHFFFAOYSA-N |
| Parent Compound | CHEMBL3754853 |
| Active Moiety | CHEMBL3754853 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
417.2
MW (Da)
4.00
ALogP
7
HBA
3
HBD
122.5
PSA (Ų)
0.62
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.83
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.83 | 5.83 | 1476.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 1476.0 | nM | 5.83 | Inhibition of Saccharomyces cerevisiae alpha-Glucosidase using p-nitrophenyl-alp... | 26706176 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 26706176 | 10.1016/j.bmcl.2015.12.009 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine