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Compound Detail

CHEMBL1184875

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CS(=O)(=O)c1ccc(-c2noc([C@@H](CC3CC3)[C@H](N)C(=O)N3CC[C@H](F)C3)n2)cc1

Basic Information

ChEMBL ID CHEMBL1184875
Phase Preclinical
Structure Type MOL
InChI Key WTLFRZGLMDADRS-XIRDDKMYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

436.5
MW (Da)
1.92
ALogP
7
HBA
1
HBD
119.4
PSA (Ų)
0.70
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H25FN4O4S
MW 436.51
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -1.36

Data from ChEMBL 36 via Core Engine