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Compound Detail

CHEMBL4595770

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CN(C)S(=O)(=O)c1ccc(OCc2cn(C/C(F)=C/CN)nn2)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595770
Phase Preclinical
Structure Type MOL
InChI Key LHOHCIQXOSODHJ-WZUFQYTHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

403.9
MW (Da)
1.57
ALogP
7
HBA
1
HBD
103.3
PSA (Ų)
0.72
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H19ClFN5O3S
MW 403.87
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -2.12

Data from ChEMBL 36 via Core Engine