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Compound Detail

CHEMBL4300921

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NS(=O)(=O)c1ccc(CCNC(=O)c2ccc(OCC(O)CN3CCOCC3)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300921
Phase Preclinical
Structure Type MOL
InChI Key FAPRANFHIROANY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

463.6
MW (Da)
0.38
ALogP
7
HBA
3
HBD
131.2
PSA (Ų)
0.46
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H29N3O6S
MW 463.56
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -1.46

Data from ChEMBL 36 via Core Engine