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Compound Detail

CHEMBL4803788

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Cc1ccc(S(=O)(=O)n2cc(-c3ccc(C(F)(F)F)cc3)c3ccc(CO[C@H](C(=O)O)[C@H](N)C(=O)O)cc32)cc1

Basic Information

ChEMBL ID CHEMBL4803788
Phase Preclinical
Structure Type MOL
InChI Key CPAPJLPIAMJYMZ-ZEQRLZLVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

576.5
MW (Da)
4.25
ALogP
7
HBA
3
HBD
148.9
PSA (Ų)
0.27
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H23F3N2O7S
MW 576.55
Aromatic Rings 4
Heavy Atoms 40
NP-Likeness -0.63

Data from ChEMBL 36 via Core Engine