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Compound Detail

CHEMBL4290672

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CC(O)Cc1oc2ccccc2c1C(=O)c1cc(I)c(O)c(I)c1

Basic Information

ChEMBL ID CHEMBL4290672
Phase Preclinical
Structure Type MOL
InChI Key SUAFCPJOVOKXGL-UHFFFAOYSA-N
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

548.1
MW (Da)
4.50
ALogP
4
HBA
2
HBD
70.7
PSA (Ų)
0.37
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H14I2O4
MW 548.11
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness 0.37

Activity Summary

IC50 4 meas. best 4.86

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Eyes absent homolog 3
CHEMBL4296245
IC50 4.86 4.86 13800.0 4

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine