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Compound Detail

CHEMBL4802563

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Nc1c(S(=O)(=O)O)cc(Nc2ccc(Nc3nc(Cl)nc(Nc4ccc(S(=O)(=O)O)c(S(=O)(=O)O)c4)n3)c(S(=O)(=O)O)c2)c2c1C(=O)c1ccccc1C2=O

Basic Information

ChEMBL ID CHEMBL4802563
Phase Preclinical
Structure Type MOL
InChI Key MIETUBKVNMXKKT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

854.2
MW (Da)
3.10
ALogP
17
HBA
8
HBD
352.4
PSA (Ų)
0.07
QED
3
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H20ClN7O14S4
MW 854.24
Aromatic Rings 5
Heavy Atoms 55
NP-Likeness -0.46

Data from ChEMBL 36 via Core Engine