Compound Detail
CHEMBL305202
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Basic Information
| ChEMBL ID | CHEMBL305202 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RJWIODMCPUQQLM-GQCTYLIASA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
207.2
MW (Da)
1.25
ALogP
3
HBA
3
HBD
69.6
PSA (Ų)
0.52
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 5.57 | 5.57 | 2700.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 2700.0 | nM | 5.57 | Evaluated for the antioxidant property by measuring the inhibition of microsomal... | 11206462 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23682762 | 10.1021/jm400374q | Unchecked | 3 |
| 11206462 | 10.1016/s0960-894x(00)00630-2 | Unchecked | 1 |
| 20181415 | 10.1016/j.ejmech.2010.01.066 | Bacillus subtilis | 1 |
| 20181415 | 10.1016/j.ejmech.2010.01.066 | Pseudomonas fluorescens | 1 |
| 20181415 | 10.1016/j.ejmech.2010.01.066 | Staphylococcus aureus | 1 |
| 20181415 | 10.1016/j.ejmech.2010.01.066 | Candida albicans | 1 |
Data from ChEMBL 36 via Core Engine