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Compound Detail

CHEMBL4301629

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NS(=O)(=O)c1ccc(CCNC(=O)c2ccc(OCC(O)CNCCO)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4301629
Phase Preclinical
Structure Type MOL
InChI Key PHBBASABJBZAAB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

437.5
MW (Da)
-0.37
ALogP
7
HBA
5
HBD
151.0
PSA (Ų)
0.28
QED
0
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H27N3O6S
MW 437.52
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -0.92

Data from ChEMBL 36 via Core Engine