Aceclidine

This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Generic Name
Aceclidine
DrugBank Accession Number
DB13262
Background

Aceclidine has been marketed in Europe but has not been used clinically in the United States. It is used in the treatment of open-angle glaucoma and is a parasympathomimetic agent.

Type
Small Molecule
Groups
Approved
Structure
Weight
Average: 169.224
Monoisotopic: 169.110278727
Chemical Formula
C9H15NO2
Synonyms
  • Aceclidina
  • Aceclidine
  • Aceclidinum

Pharmacology

Indication

Not Available

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Contraindications & Blackbox Warnings
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Pharmacodynamics

Not Available

Mechanism of action
Not Available
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Not Available
Food Interactions
Not Available

Products

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Product Ingredients
IngredientUNIICASInChI Key
Aceclidine hydrochloride3B22O325Q66109-70-2LWWSARSTZGNKGV-UHFFFAOYSA-N

Categories

ATC Codes
S01EB58 — Aceclidine, combinationsS01EB08 — Aceclidine
Drug Categories
Chemical TaxonomyProvided by Classyfire
Description
This compound belongs to the class of organic compounds known as quinuclidines. These are compounds containing a 1-azabicyclo[2.2.2]octane moiety.
Kingdom
Organic compounds
Super Class
Organoheterocyclic compounds
Class
Quinuclidines
Sub Class
Not Available
Direct Parent
Quinuclidines
Alternative Parents
Piperidines / Trialkylamines / Carboxylic acid esters / Amino acids and derivatives / Monocarboxylic acids and derivatives / Azacyclic compounds / Organopnictogen compounds / Organic oxides / Hydrocarbon derivatives / Carbonyl compounds
Substituents
Aliphatic heteropolycyclic compound / Amine / Amino acid or derivatives / Azacycle / Carbonyl group / Carboxylic acid derivative / Carboxylic acid ester / Hydrocarbon derivative / Monocarboxylic acid or derivatives / Organic nitrogen compound
Molecular Framework
Aliphatic heteropolycyclic compounds
External Descriptors
Not Available
Affected organisms
Not Available

Chemical Identifiers

UNII
0578K3ELIO
CAS number
827-61-2
InChI Key
WRJPSSPFHGNBMG-UHFFFAOYSA-N
InChI
InChI=1S/C9H15NO2/c1-7(11)12-9-6-10-4-2-8(9)3-5-10/h8-9H,2-6H2,1H3
IUPAC Name
1-azabicyclo[2.2.2]octan-3-yl acetate
SMILES
CC(=O)OC1CN2CCC1CC2

References

General References
Not Available
ChemSpider
1902
BindingDB
50034625
ChEBI
93847
ChEMBL
CHEMBL20835
Wikipedia
Aceclidine

Clinical Trials

Clinical Trials
PhaseStatusPurposeConditionsCount
3Active Not RecruitingTreatmentEye Diseases / Miosis / Near Vision / Presbyopia1
3CompletedTreatmentEye Diseases / Miosis / Near Vision / Presbyopia1
3CompletedTreatmentEye Diseases / Miosis / Near Vision / Presbyopia / Refractive Errors1
3RecruitingTreatmentEye Diseases / Miosis / Near Vision / Presbyopia1
2CompletedTreatmentEye Diseases / Miosis / Near Vision / Presbyopia / Refractive Errors1

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
Not Available
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
Water Solubility226.0 mg/mLALOGPS
logP0.9ALOGPS
logP0.3Chemaxon
logS0.13ALOGPS
pKa (Strongest Basic)9.17Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count2Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area29.54 Å2Chemaxon
Rotatable Bond Count2Chemaxon
Refractivity45.38 m3·mol-1Chemaxon
Polarizability18.19 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSsplash10-00di-0900000000-41cc4a92543529c6ddcb
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSsplash10-0a4i-0900000000-ce3893f7be861d93bcc1
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSsplash10-0229-0900000000-0df69455955b75dbf8ba
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSsplash10-0a4i-9200000000-1b83cd265f84e2ed5ca1
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSsplash10-03di-0900000000-d3d99a3ee6676c4d232b
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSsplash10-0a4i-9000000000-1d4ca7190bbdd61a3001
Predicted 1H NMR Spectrum1D NMRNot Applicable
Predicted 13C NMR Spectrum1D NMRNot Applicable
Chromatographic Properties
Collision Cross Sections (CCS)
AdductCCS Value (Å2)Source typeSource
[M-H]-133.84006
predicted
DeepCCS 1.0 (2019)
[M+H]+136.67561
predicted
DeepCCS 1.0 (2019)
[M+Na]+145.64545
predicted
DeepCCS 1.0 (2019)

Drug created at June 23, 2017 20:38 / Updated at February 21, 2021 18:54