cevimeline   Click here for help

GtoPdb Ligand ID: 9658

Synonyms: Evoxac®
Approved drug
cevimeline is an approved drug (FDA (2000))
Compound class: Synthetic organic
Comment: Cevimeline is an orally administered cholinergic analogue with parasympathomimetic activity. The INN is a mixture of enantiomers. We show the structure without stereochemistry to represent the mixture.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 0
Topological polar surface area 37.77
Molecular weight 199.1
XLogP 1.29
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CC1SCC2(O1)CN1CCC2CC1
Isomeric SMILES CC1SCC2(O1)CN1CCC2CC1
InChI InChI=1S/C10H17NOS/c1-8-12-10(7-13-8)6-11-4-2-9(10)3-5-11/h8-9H,2-7H2,1H3
InChI Key WUTYZMFRCNBCHQ-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (2000))
International Nonproprietary Names Click here for help
INN number INN
7540 cevimeline
Synonyms Click here for help
Evoxac®
Database Links Click here for help
CAS Registry No. 107233-08-9 (source: WHO INN record)
ChEMBL Ligand CHEMBL168815
DrugCentral Ligand 584
GtoPdb PubChem SID 348353617
PubChem CID 2684
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