Compound Detail
CHEMBL3916051
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 | CHEMBL3916051 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GRVKSWAJFYZCRD-PTRXRCKUSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
316.5
MW (Da)
1.22
ALogP
5
HBA
3
HBD
76.3
PSA (Ų)
0.59
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.8
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.8 | 5.8 | 1600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 1600.0 | nM | 5.8 | Inhibition of Penicillium decumbens alpha-L-rhamnosidase using p-nitrophenyl-gly... | 27789075 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27789075 | 10.1016/j.bmc.2016.10.015 | Unchecked | 12 |
| 27789075 | 10.1016/j.bmc.2016.10.015 | Tissue alpha-L-fucosidase | 1 |
| 27789075 | 10.1016/j.bmc.2016.10.015 | Uncharacterized protein | 1 |
| 27789075 | 10.1016/j.bmc.2016.10.015 | Beta-galactosidase | 1 |
| 27789075 | 10.1016/j.bmc.2016.10.015 | Alpha-mannosidase | 1 |
Data from ChEMBL 36 via Core Engine