Compound Detail
CHEMBL4168843
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Basic Information
| ChEMBL ID | CHEMBL4168843 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ALFLBPNQQXFFGM-GPTQDWHKSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
304.2
MW (Da)
-2.02
ALogP
9
HBA
7
HBD
160.1
PSA (Ų)
0.33
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.41
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| No relevant target CHEMBL2362975 | IC50 | 5.41 | 5.41 | 3900.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| No relevant target | IC50 | = | 3900.0 | nM | 5.41 | Antioxidant activity assessed as DPPH radical scavenging activity measured after... | 29300477 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 29300477 | 10.1021/acs.jnatprod.7b00564 | Tyrosinase | 1 |
| 29300477 | 10.1021/acs.jnatprod.7b00564 | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine