Compound Detail
CHEMBL85171
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Basic Information
| ChEMBL ID | CHEMBL85171 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YZCOUWUUEXAXAH-CUBOASBISA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
237.3
MW (Da)
-0.12
ALogP
4
HBA
4
HBD
72.7
PSA (Ų)
0.59
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Tissue alpha-L-fucosidase CHEMBL4176 | Ki | 6.17 | 6.17 | 680.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Tissue alpha-L-fucosidase | Ki | = | 680.0 | nM | 6.17 | In vitro inhibition of alpha-L-fucosidase isolated from bovine kidney. | 11549468 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11549468 | 10.1016/s0960-894x(01)00497-8 | Tissue alpha-L-fucosidase | 1 |
Data from ChEMBL 36 via Core Engine