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Compound Detail

CHEMBL3559236

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CN1CCN(c2cc(/C=C/c3ccccc3)[n+](C)c3ccccc23)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3559236
Phase Preclinical
Structure Type MOL
InChI Key GUKNPAPHGQVLSO-OUKQBFOZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

344.5
MW (Da)
3.59
ALogP
2
HBA
0
HBD
10.4
PSA (Ų)
0.67
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H26N3+
MW 344.48
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -0.33

Data from ChEMBL 36 via Core Engine