Compound Detail
CHEMBL4293535
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Basic Information
| ChEMBL ID | CHEMBL4293535 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HHYQSCGLSKGIGX-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
321.2
MW (Da)
3.24
ALogP
4
HBA
2
HBD
87.7
PSA (Ų)
0.84
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.22
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 4.22 | 4.22 | 60000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 60000.0 | nM | 4.22 | Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-d-glucopyranosid... | 31112894 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 30015075 | 10.1016/j.ejmech.2018.07.007 | No relevant target | 1 |
| 31112894 | 10.1016/j.ejmech.2019.04.025 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine