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Compound Detail

CHEMBL4803111

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O=C1N2C[C@@H](CC[C@H]2SC(F)(F)F)N1OS(=O)(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803111
Phase Preclinical
Structure Type MOL
InChI Key NJWAICWKJGYKIZ-RFZPGFLSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

322.3
MW (Da)
1.20
ALogP
5
HBA
1
HBD
87.2
PSA (Ų)
0.79
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C7H9F3N2O5S2
MW 322.29
Aromatic Rings 0
Heavy Atoms 19
NP-Likeness -0.34

Data from ChEMBL 36 via Core Engine