Compound Detail
CHEMBL479176
STOBADINE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL479176 |
| Name | STOBADINE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CYJQCYXRNNCURD-DGCLKSJQSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
202.3
MW (Da)
2.21
ALogP
2
HBA
1
HBD
15.3
PSA (Ų)
0.69
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 4.6
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 4.6 | 4.6 | 25300.0 | 1 |
| Radical scavenging activity CHEMBL613712 | IC50 | 4.6 | 4.6 | 25118.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Radical scavenging activity | IC50 | = | 25118.86 | nM | 4.6 | Antioxidant activity in unilamellar DOPC liposomes | 16610797 |
| NON-PROTEIN TARGET | IC50 | = | 25300.0 | nM | 4.6 | Antioxidant activity assessed as inhibition of AAPH-induced peroxidation of DOPC... | 18395454 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 37336 | 10.1021/jm00192a013 | Mus musculus | 7 |
| 37336 | 10.1021/jm00192a013 | Rattus norvegicus | 7 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 2 |
| 16610797 | 10.1021/jm060041r | Radical scavenging activity | 1 |
| 18395454 | 10.1016/j.bmc.2008.03.039 | Aldo-keto reductase family 1 member B1 | 1 |
| 18395454 | 10.1016/j.bmc.2008.03.039 | NON-PROTEIN TARGET | 1 |
| 18395454 | 10.1016/j.bmc.2008.03.039 | No relevant target | 1 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine