General
Preferred name
Scopolamine N-oxide HBr
Synonyms
Hyoscine N-oxide hydrobromide ()
Scopolamine N-oxide hydrobromide ()
Scopolamine N-Oxide HydrobroMide Monohydrate ()
Hyoscine N-oxide HydrobroMide Monohydrate ()
Genoscopolamine HydrobroMide Monohydrate ()
Scopolamin-N-oxide hydrobromide ()
P&D ID
PD053426
CAS
6106-81-6
Tags
natural product
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
2
Prestwick Chemical Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
8
Properties
(calculated by RDKit )
Molecular Weight
399.07
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
1
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
1
cLogP
1.51
TPSA
82.12
Fraction CSP3
0.59
Chiral centers
7.0
Largest ring
6.0
QED
0.36
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Neuroscience
Target
mAChR
Sucrase-isomaltase
MOA
AChR antagonist
Others antagonist
Source data
