General
Preferred name
OXOTREMORINE
Synonyms
OXOTREMORINE SESQUIFUMARATE ()
OXOTREMORINE SESQUIFUMARATE SALT ()
Green tea ()
Oxotremorine (sesquifumarate) ()
But-2-enedioic acid ()
1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidin-2-one ()
P&D ID
PD048315
CAS
17360-35-9
70-22-4
Tags
available
drug candidate
Drug indication
Discovery agent
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 75
DESCRIPTION Oxotremorine sesquifumarate is a mAChR agonist that mainly activates M2 receptors. Oxotremorine sesquifumarate can be used for neurological research[1][2].
DESCRIPTION Group III and group II mGlu antagonist; more selective for group III than group II (Tocris Bioactive Compound Library)
DESCRIPTION Muscarinic acetylcholine receptor agonist with preference for the M2 receptor (LOPAC library)
DESCRIPTION Muscarinic agonist (Tocriscreen Total)
DESCRIPTION Muscarinic agonist (Tocriscreen Plus)
DESCRIPTION Oxotremorine sesquifumarate is a muscarinic agonist. (TargetMol Bioactive Compound Library)
DESCRIPTION A derivative of Oxotremorine. Oxotremorine is a selective muscarinic acetylcholine receptor agonist. It can be used as a parasympathomimetic drug. (BOC Sciences Bioactive Compounds)
Cell lines
0
Organisms
1
Compound Sets
19
Cayman Chemical Bioactives
Concise Guide to Pharmacology 2021/22
Concise Guide to Pharmacology 2023/24
CZ-OPENSCREEN Bioactive Library
Drug Repurposing Hub
DrugMAP
DrugMatrix
Guide to Pharmacology
Ki Database
LOPAC library
Mcule NIBR MoA Box Subset
MedChem Express Bioactive Compound Library
Novartis Chemogenetic Library (NIBR MoA Box)
Other bioactive compounds
TargetMol Bioactive Compound Library
Tocris Bioactive Compound Library
Tocriscreen Plus
Tocriscreen Total
External IDs
42
Properties
(calculated by RDKit )
Molecular Weight
206.14
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
2
Ring Count
2
Aromatic Ring Count
0
cLogP
0.71
TPSA
23.55
Fraction CSP3
0.75
Chiral centers
0.0
Largest ring
5.0
QED
0.62
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target Type
7-TM Receptors
Selectivity
M2
Target
mAChR
CHRM1, CHRM2, CHRM3, CHRM4
Primary Target
Non-selective Muscarinics
MOA
Agonist
Muscarinic receptor agonist
cholinergic receptor agonist
Member status
member
Pathway
Neuroscience
GPCR/G protein
Neuronal Signaling
Source data