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Compound Detail

CHEMBL5222856

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C[N+](CCOc1ccc(/C=C/c2ccccc2)cc1)(C1CCCCC1)C1CCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5222856
Phase Preclinical
Structure Type MOL
InChI Key NDIDWVRRXNJZOW-ISLYRVAYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

418.6
MW (Da)
7.35
ALogP
1
HBA
0
HBD
9.2
PSA (Ų)
0.32
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H40NO+
MW 418.65
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -0.09

Data from ChEMBL 36 via Core Engine