Compound Detail
CHEMBL4129640
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Basic Information
| ChEMBL ID | CHEMBL4129640 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DCLREUADIYRZAZ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
274.3
MW (Da)
1.83
ALogP
4
HBA
4
HBD
80.9
PSA (Ų)
0.67
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.07 | 6.07 | 860.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 860.0 | nM | 6.07 | Inhibition of yeast alpha-glucosidase using p-nitrophenyl-alpha-glucopyranoside ... | 28497968 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 28497968 | 10.1021/acs.jnatprod.7b00250 | Unchecked | 2 |
Data from ChEMBL 36 via Core Engine