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Compound Detail

CHEMBL1373715

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COc1ccccc1N1CCN(S(=O)(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1

Basic Information

ChEMBL ID CHEMBL1373715
Phase Preclinical
Structure Type MOL
InChI Key AFJVMYCLBGOHRA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

468.4
MW (Da)
4.24
ALogP
4
HBA
0
HBD
49.9
PSA (Ų)
0.63
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H18F6N2O3S
MW 468.42
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -1.50

Data from ChEMBL 36 via Core Engine