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Compound Detail

CHEMBL4302894

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CCOC(=O)c1c(C)cc(OCCCCCCCCCCCCC[n+]2cccc3ccccc32)cc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4302894
Phase Preclinical
Structure Type MOL
InChI Key DHJFCNJELPYOGQ-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

506.7
MW (Da)
7.69
ALogP
4
HBA
1
HBD
59.6
PSA (Ų)
0.12
QED
2
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H44NO4+
MW 506.71
Aromatic Rings 3
Heavy Atoms 37

Data from ChEMBL 36 via Core Engine