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Compound Detail

CHEMBL5222994

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O=C(Nc1ccc(N2CCOCC2)c(Br)c1)NS(=O)(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5222994
Phase Preclinical
Structure Type MOL
InChI Key IPWQJRHKJHXDCS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

380.2
MW (Da)
1.21
ALogP
5
HBA
3
HBD
108.0
PSA (Ų)
0.68
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H14BrN3O5S
MW 380.22
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -1.46

Data from ChEMBL 36 via Core Engine