Compound Detail
CHEMBL205380
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Basic Information
| ChEMBL ID | CHEMBL205380 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XLFYUKCBTCDERW-MNOVXSKESA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
369.3
MW (Da)
3.42
ALogP
4
HBA
1
HBD
50.8
PSA (Ų)
0.82
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.71
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Radical scavenging activity CHEMBL613712 | IC50 | 4.71 | 4.71 | 19498.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Radical scavenging activity | IC50 | = | 19498.45 | nM | 4.71 | Antioxidant activity in unilamellar DOPC liposomes | 16610797 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16610797 | 10.1021/jm060041r | Radical scavenging activity | 1 |
Data from ChEMBL 36 via Core Engine