(+)-aceclidine   Click here for help

GtoPdb Ligand ID: 286

Synonyms: S-(+)-aceclidine
Compound class: Synthetic organic
Comment: The INN-assigned compound aceclidine is a racemic mixture of two enantiomers: S(+)-aceclidine and R(-)-aceclidine. Note that ChEMBL represents this compound without the charge in the entry CHEMBL608828.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 30.74
Molecular weight 170.12
XLogP 0.5
No. Lipinski's rules broken 0
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Canonical SMILES CC(=O)OC1C[NH+]2CCC1CC2
Isomeric SMILES CC(=O)O[C@@H]1C[NH+]2CCC1CC2
InChI InChI=1S/C9H15NO2/c1-7(11)12-9-6-10-4-2-8(9)3-5-10/h8-9H,2-6H2,1H3/p+1/t9-/m1/s1
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
1367 aceclidine
Synonyms Click here for help
Database Links Click here for help
Specialist databases
GPCRdb Ligand (+)-aceclidine
Other databases
CAS Registry No. 827-61-2 (source: Scifinder)
GtoPdb PubChem SID 135649887
PubChem CID 6954180
Search Google for chemical match using the InChIKey WRJPSSPFHGNBMG-SECBINFHSA-O
Search Google for chemicals with the same backbone WRJPSSPFHGNBMG
Search PubMed clinical trials aceclidine
Search PubMed titles aceclidine
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UniChem Compound Search for chemical match using the InChIKey WRJPSSPFHGNBMG-SECBINFHSA-O
UniChem Connectivity Search for chemical match using the InChIKey WRJPSSPFHGNBMG-SECBINFHSA-O
Wikipedia Aceclidine