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Compound Detail

CHEMBL1208290

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Nc1c(S(=O)(=O)O)cc(Nc2ccc(Cl)cc2C(=O)O)c2c1C(=O)c1ccccc1C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1208290
Phase Preclinical
Structure Type MOL
InChI Key AWDHCCPCIMVLNR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

472.9
MW (Da)
3.39
ALogP
7
HBA
4
HBD
163.9
PSA (Ų)
0.26
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H13ClN2O7S
MW 472.86
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -0.44

Data from ChEMBL 36 via Core Engine