Compound Detail
CHEMBL3941602
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Basic Information
| ChEMBL ID | CHEMBL3941602 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LVQNELRNZDYNTF-VAWYXSNFSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
300.4
MW (Da)
4.25
ALogP
3
HBA
0
HBD
64.7
PSA (Ų)
0.75
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.48
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| No relevant target CHEMBL2362975 | IC50 | 5.48 | 4.805 | 3300.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| No relevant target | IC50 | = | 3300.0 | nM | 5.48 | Antioxidant activity assessed as AAPH free radical scavenging activity measured ... | 27267003 |
| No relevant target | IC50 | = | 74000.0 | nM | 4.13 | Antioxidant activity assessed as DPPH free radical scavenging activity after 60 ... | 27267003 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 27267003 | 10.1016/j.ejmech.2016.05.040 | No relevant target | 5 |
Data from ChEMBL 36 via Core Engine