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Compound Detail

CHEMBL4595207

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O=S(=O)(/C=C/c1ccccn1)c1ccc(OCCCN2CCOCC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595207
Phase Preclinical
Structure Type MOL
InChI Key JNSPNTYNLJVFCY-RQZCQDPDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

388.5
MW (Da)
2.63
ALogP
6
HBA
0
HBD
68.7
PSA (Ų)
0.65
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H24N2O4S
MW 388.49
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -1.49

Data from ChEMBL 36 via Core Engine