Compound Detail
CHEMBL346766
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Basic Information
| ChEMBL ID | CHEMBL346766 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LHQZGSHKSWKMBX-KAMYIIQDSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
198.3
MW (Da)
2.54
ALogP
2
HBA
0
HBD
17.3
PSA (Ų)
0.62
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amine oxidase [flavin-containing] A CHEMBL1951 | IC50 | 6.04 | 6.04 | 920.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amine oxidase [flavin-containing] A | IC50 | = | 920.0 | nM | 6.04 | Compound was tested for inhibition of monoamine oxidase-A (MAO-A). | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(96)00072-8 | Amine oxidase [flavin-containing] A | 1 |
| - | 10.1016/0960-894X(96)00072-8 | Amine oxidase [flavin-containing] B | 1 |
Data from ChEMBL 36 via Core Engine