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Compound Detail

CHEMBL5997626

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O=C(O)C1C(C(=O)Nc2ccc(I)cc2)C2CCC1C21CC1

Basic Information

ChEMBL ID CHEMBL5997626
Phase Preclinical
Structure Type MOL
InChI Key HODHGTJKKQCSBF-UHFFFAOYSA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

411.2
MW (Da)
3.37
ALogP
2
HBA
2
HBD
66.4
PSA (Ų)
0.75
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H18INO3
MW 411.24
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness -0.41

Activity Summary

EC50 3 meas. best 9.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
N-formyl peptide receptor 2
CHEMBL4227
EC50 9.22 9.22 0.6 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine