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Compound Detail

CHEMBL5222148

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CC[N+](C)(CC)[C@H]1C[C@H]1Oc1ccc(/C=C/c2ccccc2)cc1

Basic Information

ChEMBL ID CHEMBL5222148
Phase Preclinical
Structure Type MOL
InChI Key IZXOINQUSUGYPF-QFBGAIGZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

322.5
MW (Da)
4.86
ALogP
1
HBA
0
HBD
9.2
PSA (Ų)
0.52
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H28NO+
MW 322.47
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness 0.34

Data from ChEMBL 36 via Core Engine