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Compound Detail

CHEMBL1206242

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CC(C)c1c(S(=O)(=O)Nc2ccc(S(N)(=O)=O)cc2)c(-c2ccc(F)cc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(=O)O

Basic Information

ChEMBL ID CHEMBL1206242
Phase Preclinical
Structure Type MOL
InChI Key XVDTXKNUSWJVBR-CLJLJLNGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

691.8
MW (Da)
4.65
ALogP
8
HBA
5
HBD
189.0
PSA (Ų)
0.13
QED
1
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H35F2N3O8S2
MW 691.78
Aromatic Rings 4
Heavy Atoms 47
NP-Likeness -0.69

Data from ChEMBL 36 via Core Engine