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Compound Detail

CHEMBL4598062

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C[C@H](NS(=O)(=O)c1ccc(OC/C(F)=C/CN)cc1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4598062
Phase Preclinical
Structure Type MOL
InChI Key ZVFVOMFIUGHFMF-HNDQUVLASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

364.4
MW (Da)
2.92
ALogP
4
HBA
2
HBD
81.4
PSA (Ų)
0.75
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 C18H21FN2O3S
MW 364.44
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -1.15

Data from ChEMBL 36 via Core Engine