Compound Detail
CHEMBL444472
PHENOL A Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL444472 |
| Name | PHENOL A |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZYUVGYBAPZYKSA-HTRCEHHLSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
196.2
MW (Da)
1.89
ALogP
3
HBA
3
HBD
60.7
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 4.65
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Radical scavenging activity CHEMBL613712 | IC50 | 4.65 | 4.65 | 22500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Radical scavenging activity | IC50 | = | 22500.0 | nM | 4.65 | Antioxidant activity assessed as DPPH free radical scavenging activity after 30 ... | 18281952 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18281952 | 10.1021/np0704708 | Radical scavenging activity | 1 |
| 21761866 | 10.1021/jm200511x | HL-60 | 1 |
| 21761866 | 10.1021/jm200511x | HCT-116 | 1 |
| 21761866 | 10.1021/jm200511x | KB | 1 |
Data from ChEMBL 36 via Core Engine