Compound Detail
CHEMBL193872
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Basic Information
| ChEMBL ID | CHEMBL193872 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DGBHUSPLAMIWPQ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
379.6
MW (Da)
6.09
ALogP
3
HBA
0
HBD
7.1
PSA (Ų)
0.51
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| RAW264.7 CHEMBL612557 | IC50 | 6.7 | 6.7 | 198.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| RAW264.7 | IC50 | = | 198.0 | nM | 6.7 | Suppression of nitric oxide production in the LPS/IFN gamma stimulated RAW264.7 ... | 15808462 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15808462 | 10.1016/j.bmcl.2005.02.063 | RAW264.7 | 2 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine