Compound Detail
CHEMBL2270659
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Basic Information
| ChEMBL ID | CHEMBL2270659 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | SIMCYXYXEVCBJJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
240.2
MW (Da)
0.16
ALogP
4
HBA
3
HBD
74.1
PSA (Ų)
0.70
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Uncharacterized protein CHEMBL2176863 | IC50 | 4.12 | 4.12 | 75857.8 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Uncharacterized protein | IC50 | = | 75857.76 | nM | 4.12 | Inhibition of Sus scrofa (pig) trehalase using trehaloase as substrate incubated... | 11714317 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11714317 | 10.1021/jf010632k | Drosophila melanogaster | 2 |
| 11714317 | 10.1021/jf010632k | Uncharacterized protein | 1 |
Data from ChEMBL 36 via Core Engine