Compound Detail
CHEMBL2261891
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Basic Information
| ChEMBL ID | CHEMBL2261891 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MAOCCGZSMYLPJX-MHWRWJLKSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
255.3
MW (Da)
1.94
ALogP
4
HBA
2
HBD
74.6
PSA (Ų)
0.65
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.94
IC50 1 meas. best 4.9
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| H9c2 CHEMBL614576 | EC50 | 4.94 | 4.94 | 11400.0 | 1 |
| Rattus norvegicus CHEMBL376 | IC50 | 4.9 | 4.9 | 12600.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| H9c2 | EC50 | = | 11400.0 | nM | 4.94 | Protection against t-BHP-induced oxidative injury in rat H9c2 cells assessed as ... | 27187862 |
| Rattus norvegicus | IC50 | = | 12600.0 | nM | 4.9 | Cytotoxicity against rat H9c2 cells assessed as decrease in cell viability after... | 27187862 |
Literature References
Data from ChEMBL 36 via Core Engine