Compound Detail
CHEMBL2165610
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Basic Information
| ChEMBL ID | CHEMBL2165610 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | URMQKRJNQZRAGH-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
226.2
MW (Da)
1.56
ALogP
2
HBA
2
HBD
57.9
PSA (Ų)
0.83
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.97
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Superoxide dismutase [Cu-Zn] CHEMBL2354 | EC50 | 5.97 | 5.97 | 1070.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Superoxide dismutase [Cu-Zn] | EC50 | = | 1070.0 | nM | 5.97 | Inhibition of SOD1 G93A mutant aggregation-induced cytotoxicity in rat PC12 cell... | 22191331 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22191331 | 10.1021/jm2014277 | Superoxide dismutase [Cu-Zn] | 2 |
Data from ChEMBL 36 via Core Engine