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

CHEMBL1343383

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
Cc1ccc[n+](CC(=O)c2ccccc2)c1.[Br-]

Basic Information

ChEMBL ID CHEMBL1343383
Phase Preclinical
Structure Type MOL
InChI Key FYQZEXKCSQRJAV-UHFFFAOYSA-M
Parent Compound CHEMBL1617228
Active Moiety CHEMBL1617228
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

212.3
MW (Da)
2.17
ALogP
1
HBA
0
HBD
20.9
PSA (Ų)
0.56
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H14BrNO
MW 292.18
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.66

Activity Summary

IC50 1 meas. best 5.24

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Polyadenylate-binding protein 1
CHEMBL1293286
IC50 5.24 5.24 5700.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Polyadenylate-binding protein 1 IC50 = 5700.0 nM 5.24 PUBCHEM_BIOASSAY: uHTS fluorescence polarization assay for the identification of... -

Data from ChEMBL 36 via Core Engine