Compound Detail
CHEMBL3184493
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Basic Information
| ChEMBL ID | CHEMBL3184493 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JTTANBUHOOYWRX-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
284.3
MW (Da)
-0.08
ALogP
8
HBA
0
HBD
95.6
PSA (Ų)
0.65
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 6.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Dihydrolipoyl dehydrogenase CHEMBL3988585 | IC50 | 6.72 | 6.72 | 190.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Dihydrolipoyl dehydrogenase | IC50 | = | 190.0 | nM | 6.72 | Inhibition Assay: The assay was performed in a manner similar to that described ... | - |
Data from ChEMBL 36 via Core Engine