Compound Detail
CHEMBL5788357
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL5788357 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YRZDNEXRVQCHMM-HUUCEWRRSA-N |
1
Targets
5
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
361.5
MW (Da)
3.17
ALogP
6
HBA
2
HBD
76.4
PSA (Ų)
0.83
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 5 meas. best 4.44
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Amine oxidase [flavin-containing] A CHEMBL1951 | IC50 | 4.44 | 4.44 | 36000.0 | 5 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Amine oxidase [flavin-containing] A | IC50 | = | 36000.0 | nM | 4.44 | MAO-A Inhibitory Activity: The MAO-A inhibitory activity evaluation described be... | - |
| Amine oxidase [flavin-containing] A | IC50 | = | 36000.0 | nM | 4.44 | MAO-A Inhibitory Assay: The MAO-A inhibitory activity evaluation described below... | - |
| Amine oxidase [flavin-containing] A | IC50 | = | 36000.0 | nM | 4.44 | MAO-A Inhibitory Assay: A test compound dissolved in DMSO was added to a reactio... | - |
| Amine oxidase [flavin-containing] A | IC50 | = | 36000.0 | nM | 4.44 | Inhibition Assay: A test compound dissolved in DMSO was added to a reaction solu... | - |
| Amine oxidase [flavin-containing] A | IC50 | = | 36000.0 | nM | 4.44 | Inhibition Activity Assay: MAO-A: The MAO-A inhibitory activity evaluation descr... | - |
Data from ChEMBL 36 via Core Engine