Compound Detail
CHEMBL223155
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Basic Information
| ChEMBL ID | CHEMBL223155 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | MZKALFCNIJHTJG-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
236.3
MW (Da)
2.83
ALogP
2
HBA
0
HBD
32.7
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| No relevant target CHEMBL2362975 | IC50 | 5.52 | 5.49 | 3000.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| No relevant target | IC50 | = | 3000.0 | nM | 5.52 | Antioxidant activity assessed as copper-chelating scavenging activity | 32241621 |
| No relevant target | IC50 | = | 3500.0 | nM | 5.46 | Inhibition of lipid peroxidation | 32241621 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 17850126 | 10.1021/jm070688r | ScN2a | 2 |
| 32241621 | 10.1016/j.bmc.2020.115463 | No relevant target | 2 |
| 17850126 | 10.1021/jm070688r | NON-PROTEIN TARGET | 1 |
| 17850126 | 10.1021/jm070688r | NB69 | 1 |
| 17850126 | 10.1021/jm070688r | ADMET | 1 |
Data from ChEMBL 36 via Core Engine