General
Preferred name
PIPEROXAN
Synonyms
Benodaine Hydrochloride ()
dl-Piperoxan hydrochloride ()
Piperoxan hydrochloride ()
Piperoxan (hydrochloride) ()
Benodaine, Fourneau 933, F933, DL-Piperoxan ()
Fourneau-933 ()
(rs)-piperoxane ()
Piperoxane ()
Benzodioxane ()
F-933 ()
Benodaine ()
P&D ID
PD014635
CAS
135-87-5
59-39-2
Tags
available
drug candidate
Drug indication
Discovery agent
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
10
Cayman Chemical Bioactives
ChEMBL Drugs
DrugMAP
DrugMatrix
Ki Database
MedChem Express Bioactive Compound Library
NPC Screening Collection
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
27
Properties
(calculated by RDKit )
Molecular Weight
233.14
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
0
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
1
cLogP
2.31
TPSA
21.7
Fraction CSP3
0.57
Chiral centers
1.0
Largest ring
6.0
QED
0.78
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
GPCR/G protein
Neuronal Signaling
Target
??2 receptor
¦Á2 receptor
Adrenergic Receptor
MOA
Adrenergic Receptor antagonist
Source data
