Compound Detail
CHEMBL5077606
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Basic Information
| ChEMBL ID | CHEMBL5077606 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OVJINGSHOOFYLU-WRWGMCAJSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
302.3
MW (Da)
-3.08
ALogP
9
HBA
5
HBD
135.1
PSA (Ų)
0.37
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 4.21
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Kd | 4.21 | 4.21 | 61610.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Kd | = | 61610.0 | nM | 4.21 | Inhibition of Aspergillus niger alpha-glucosidase | 33886333 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 33886333 | 10.1021/acs.jmedchem.1c00036 | Unchecked | 5 |
| 33886333 | 10.1021/acs.jmedchem.1c00036 | Alpha-mannosidase | 1 |
Data from ChEMBL 36 via Core Engine