Compound Detail
CHEMBL2177691
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Basic Information
| ChEMBL ID | CHEMBL2177691 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JLFGJGJPCNORDM-NAKRPEOUSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
217.3
MW (Da)
-0.13
ALogP
4
HBA
4
HBD
72.7
PSA (Ų)
0.52
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 6.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Acidic alpha-glucosidase CHEMBL3513 | IC50 | 6.72 | 6.72 | 190.0 | 1 |
| Sucrase-isomaltase, intestinal CHEMBL3114 | IC50 | 6.62 | 5.77 | 240.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Acidic alpha-glucosidase | IC50 | = | 190.0 | nM | 6.72 | Inhibition of rat intestinal maltase using moltose as substrate | 23106358 |
| Sucrase-isomaltase, intestinal | IC50 | = | 240.0 | nM | 6.62 | Inhibition of rat intestinal sucrase using sucrose as substrate | 23106358 |
| Sucrase-isomaltase, intestinal | IC50 | = | 12000.0 | nM | 4.92 | Inhibition of rat intestinal isomaltase using isomaltase as substrate | 23106358 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23106358 | 10.1021/jm301304e | Sucrase-isomaltase, intestinal | 2 |
| 23106358 | 10.1021/jm301304e | Acidic alpha-glucosidase | 1 |
Data from ChEMBL 36 via Core Engine