Compound Detail
CHEMBL1731722
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Basic Information
| ChEMBL ID | CHEMBL1731722 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GTXSOJXQRYXSCB-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1740928 |
| Active Moiety | CHEMBL1740928 |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
354.4
MW (Da)
2.09
ALogP
6
HBA
1
HBD
76.6
PSA (Ų)
0.68
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 4.99
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Probable global transcription activator SNF2L2 CHEMBL2362979 | EC50 | 4.99 | 4.99 | 10210.0 | 1 |
| Mitochondrial peptide methionine sulfoxide reductase CHEMBL2007622 | EC50 | 4.33 | 4.33 | 46499.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Probable global transcription activator SNF2L2 | EC50 | = | 10210.0 | nM | 4.99 | PubChem BioAssay. Luminescence-based cell-based high throughput dose response as... | - |
| Mitochondrial peptide methionine sulfoxide reductase | EC50 | = | 46499.0 | nM | 4.33 | PUBCHEM_BIOASSAY: Absorbance-based biochemical high throughput dose response ass... | - |
Data from ChEMBL 36 via Core Engine