Compound Detail
CHEMBL232244
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Basic Information
| ChEMBL ID | CHEMBL232244 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RTVUDPFAUMGQAC-DMTCNVIQSA-N |
1
Targets
5
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
101.1
MW (Da)
-1.21
ALogP
3
HBA
2
HBD
52.8
PSA (Ų)
0.40
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 6.7
IC50 1 meas.
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 6.7 | 6.405 | 200.0 | 4 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 200.0 | nM | 6.7 | Inhibition of green coffee bean alpha-D-galactosidase | 17434740 |
| Unchecked | Ki | = | 200.0 | nM | 6.7 | Inhibition of Escherichia coli beta-D-galactosidase | 17434740 |
| Unchecked | Ki | = | 300.0 | nM | 6.52 | Inhibition of almond beta-D-glucosidase | 17434740 |
| Unchecked | Ki | = | 2000.0 | nM | 5.7 | Inhibition of jack bean alpha-D-mannosidase | 17434740 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17434740 | 10.1016/j.bmc.2007.03.073 | Unchecked | 5 |
Data from ChEMBL 36 via Core Engine