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Compound Detail

CHEMBL1996652

METHYLBENACTYZIUM
🧪 Phase II
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🧪 Phase II
CC[N+](C)(CC)CCOC(=O)C(O)(c1ccccc1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1996652
Name METHYLBENACTYZIUM
Phase Phase II
Structure Type MOL
InChI Key HDAMOICMOAXFLJ-UHFFFAOYSA-N

Known Names

Diethyllachesine Methylbenactyzium cation Methylbenactyzium ion
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
3
Known Names

Molecular Properties

342.5
MW (Da)
2.95
ALogP
3
HBA
1
HBD
46.5
PSA (Ų)
0.59
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product
USAN Stem -ium

Extended Properties

Molecular Formula C21H28NO3+
MW 342.46
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.10

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4651402 SARS-CoV-2 2

Data from ChEMBL 36 via Core Engine