Compound Detail
CHEMBL3686727
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Basic Information
| ChEMBL ID | CHEMBL3686727 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XSEKDFRDEGMLRO-VVULQXIFSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
290.3
MW (Da)
-1.77
ALogP
8
HBA
3
HBD
94.8
PSA (Ų)
0.55
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.85
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Protein O-GlcNAcase CHEMBL5921 | Ki | 6.85 | 6.85 | 142.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Protein O-GlcNAcase | Ki | = | 142.0 | nM | 6.85 | Fluorescence-Based Assay: Enzymatic reactions were carried out in a reaction con... | - |
Data from ChEMBL 36 via Core Engine