Compound Detail
CHEMBL242515
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Basic Information
| ChEMBL ID | CHEMBL242515 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | IQJICBDZRSNSEJ-UHFFFAOYSA-N |
2
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
211.2
MW (Da)
2.39
ALogP
2
HBA
2
HBD
53.1
PSA (Ų)
0.56
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.57
IC50 1 meas. best 5.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Radical scavenging activity CHEMBL613712 | EC50 | 5.57 | 5.57 | 2700.0 | 1 |
| Unchecked CHEMBL612545 | IC50 | 5.29 | 5.29 | 5130.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Radical scavenging activity | EC50 | = | 2700.0 | nM | 5.57 | Antioxidant activity assessed as DPPH free radical scavenging activity after 30 ... | 20452101 |
| Unchecked | IC50 | = | 5130.0 | nM | 5.29 | PUBCHEM_BIOASSAY: A biochemical assay using the ADP-Hunter methodology, purified... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20452101 | 10.1016/j.ejmech.2010.04.013 | HaCaT | 2 |
| 17317193 | 10.1016/j.bmc.2007.02.017 | Broad substrate specificity ATP-binding cassette transporter ABCG2 | 1 |
| 20452101 | 10.1016/j.ejmech.2010.04.013 | Radical scavenging activity | 1 |
Data from ChEMBL 36 via Core Engine