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Compound Detail

CHEMBL4440930

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CN(C(=O)CNC(=O)c1ccc2cc[nH]c2c1)C1CCS(=O)(=O)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4440930
Phase Preclinical
Structure Type MOL
InChI Key CZEJJMMHAOOROL-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

363.4
MW (Da)
0.93
ALogP
4
HBA
2
HBD
99.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H21N3O4S
MW 363.44
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -1.68

Data from ChEMBL 36 via Core Engine