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Compound Detail

CHEMBL1364684

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C[n+]1ccccc1/C=C/c1ccc(F)c(F)c1.[I-]

Basic Information

ChEMBL ID CHEMBL1364684
Phase Preclinical
Structure Type MOL
InChI Key ZMOCJKFDFBOOED-GZOLSCHFSA-M
Parent Compound CHEMBL1616919
Active Moiety CHEMBL1616919
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

232.2
MW (Da)
2.96
ALogP
0
HBA
0
HBD
3.9
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H12F2IN
MW 359.16
Aromatic Rings 2
Heavy Atoms 17
NP-Likeness -0.90

Activity Summary

IC50 2 meas. best 5.37

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Polyadenylate-binding protein 1
CHEMBL1293286
IC50 5.37 5.37 4320.0 1
Eukaryotic translation initiation factor 4H
CHEMBL1293274
IC50 4.01 4.01 97910.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine