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Compound Detail

CHEMBL5955311

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C[C@](O)(CS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1cc(C(F)(F)F)ccn1

Basic Information

ChEMBL ID CHEMBL5955311
Phase Preclinical
Structure Type MOL
InChI Key ZNUCGNIOHAFTFG-HNNXBMFYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

406.4
MW (Da)
2.40
ALogP
5
HBA
2
HBD
96.4
PSA (Ų)
0.59
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H14F4N2O4S
MW 406.36
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -1.35

Activity Summary

IC50 2 meas. best 5.81

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Androgen receptor
CHEMBL1871
IC50 5.81 5.36 1550.0 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine