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Compound Detail

CHEMBL1741054

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CC1(C)[C@H](C(=O)O)N2C(=O)[C@@H](NS(=O)(=O)C(F)(F)F)[C@H]2S1(=O)=O

Basic Information

ChEMBL ID CHEMBL1741054
Phase Preclinical
Structure Type MOL
InChI Key MKYKOVWZXOFQAA-ALEPSDHESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

380.3
MW (Da)
-1.38
ALogP
6
HBA
2
HBD
137.9
PSA (Ų)
0.58
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H11F3N2O7S2
MW 380.32
Aromatic Rings 0
Heavy Atoms 23
NP-Likeness -0.08

Data from ChEMBL 36 via Core Engine