Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL5435433

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
O=C(CNCc1ccc(OCc2cccc(Cl)c2)cc1)NCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5435433
Phase Preclinical
Structure Type MOL
InChI Key IEDFCNZXCUMEMQ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

394.9
MW (Da)
4.33
ALogP
3
HBA
2
HBD
50.4
PSA (Ų)
0.57
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H23ClN2O2
MW 394.90
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -1.35

Activity Summary

Kd 1 meas. best 5.57

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glucose-induced degradation protein 4 homolog
CHEMBL5169174
 Kd 5.57 5.57 2700.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Glucose-induced degradation protein 4 homolog Kd = 2700.0 nM 5.57 Binding affinity to recombinant GID4 (unknown origin) assessed as dissociation c... 38516600

Literature References

PubMed DOI Target Context # Activities
38516600 10.1039/d3md00633f Glucose-induced degradation protein 4 homolog 2

Data from ChEMBL 36 via Core Engine