Compound Detail
CHEMBL5276306
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Basic Information
| ChEMBL ID | CHEMBL5276306 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KBIVDWIPYXDCTJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
371.5
MW (Da)
3.84
ALogP
5
HBA
2
HBD
83.4
PSA (Ų)
0.84
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.23
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Pancreatic alpha-amylase CHEMBL5730 | IC50 | 6.23 | 6.23 | 590.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Pancreatic alpha-amylase | IC50 | = | 590.0 | nM | 6.23 | Inhibition of porcine pancreatic alpha-amylase using starch as substrate incubat... | 37122544 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37122544 | 10.1039/d2md00431c | Pancreatic alpha-amylase | 1 |
Data from ChEMBL 36 via Core Engine