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Compound Detail

CHEMBL100622

HEXAMETHONIUM
🧪 Phase II
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🧪 Phase II
C[N+](C)(C)CCCCCC[N+](C)(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL100622
Name HEXAMETHONIUM
Phase Phase II
Structure Type MOL
InChI Key VZJFGSRCJCXDSG-UHFFFAOYSA-N

Known Names

Hexamethone Hexamethonium cation Hexamethonium ion Hexathonide
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
4
Known Names

Molecular Properties

202.4
MW (Da)
1.96
ALogP
0
HBA
0
HBD
0.0
PSA (Ų)
0.44
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product
USAN Stem -ium; -onium

Extended Properties

Molecular Formula C12H30N2+2
MW 202.39
Aromatic Rings 0
Heavy Atoms 14
NP-Likeness 0.56

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
38318365 10.1016/j.isci.2024.108907 Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 1

Data from ChEMBL 36 via Core Engine