Compound Detail
CHEMBL3310948
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Basic Information
| ChEMBL ID | CHEMBL3310948 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CHGXPWLOYQOAAE-WWIHJBQESA-N |
| Parent Compound | CHEMBL3545483 |
| Active Moiety | CHEMBL3545483 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
294.3
MW (Da)
2.79
ALogP
6
HBA
2
HBD
79.6
PSA (Ų)
0.57
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| No relevant target CHEMBL2362975 | IC50 | 4.7 | 4.7 | 19900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| No relevant target | IC50 | = | 19900.0 | nM | 4.7 | Antioxidant activity assessed as DPPH radical scavenging activity by UV-Visible ... | 24924425 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 24924425 | 10.1016/j.bmc.2014.05.034 | No relevant target | 3 |
| 24924425 | 10.1016/j.bmc.2014.05.034 | NON-PROTEIN TARGET | 2 |
Data from ChEMBL 36 via Core Engine