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Compound Detail

CHEMBL2028031

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CCCN[C@@H]1CCc2c(cccc2CS(=O)(=O)C(F)(F)F)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2028031
Phase Preclinical
Structure Type MOL
InChI Key NNGXRRFVMCSLCM-CYBMUJFWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

335.4
MW (Da)
2.98
ALogP
3
HBA
1
HBD
46.2
PSA (Ų)
0.90
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H20F3NO2S
MW 335.39
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness -0.40

Data from ChEMBL 36 via Core Engine