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Compound Detail

CHEMBL4597452

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Cc1c(-c2cccc(S(=O)(=O)N(C)C)c2)c2cc(NS(C)(=O)=O)ccc2n1C/C(F)=C/CN
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4597452
Phase Preclinical
Structure Type MOL
InChI Key FHUDTBDZOLHKBL-YVLHZVERSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

494.6
MW (Da)
3.05
ALogP
6
HBA
2
HBD
114.5
PSA (Ų)
0.50
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 C22H27FN4O4S2
MW 494.61
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -1.50

Data from ChEMBL 36 via Core Engine