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Compound Detail

CHEMBL5498662

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CC[N+](CC)(CC)CCOc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5498662
Phase Preclinical
Structure Type MOL
InChI Key YHXCBJLQOJZNRM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

222.3
MW (Da)
2.94
ALogP
1
HBA
0
HBD
9.2
PSA (Ų)
0.64
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H24NO+
MW 222.35
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.39

Data from ChEMBL 36 via Core Engine