propantheline

Ligand id: 329

Name: propantheline

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 35.53
Molecular weight 368.22
XLogP 5.43
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1953))
IUPAC Name
methyl-di(propan-2-yl)-[2-(9H-xanthene-9-carbonyloxy)ethyl]azanium
International Nonproprietary Names
INN number INN
226 propantheline bromide
Synonyms
Pro-Banthine®
Database Links
CAS Registry No. 298-50-0
ChEMBL Ligand CHEMBL1180725
DrugBank Ligand DB00782
PubChem CID 4934
Search Google for chemical match using the InChIKey VVWYOYDLCMFIEM-UHFFFAOYSA-N
Search Google for chemicals with the same backbone VVWYOYDLCMFIEM
Search PubMed clinical trials propantheline bromide
Search PubMed titles propantheline bromide
Search PubMed titles/abstracts propantheline bromide
Search UniChem for chemical match using the InChIKey VVWYOYDLCMFIEM-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone VVWYOYDLCMFIEM
Wikipedia Propantheline_bromide
Comments
Propantheline is a non-selective muscarinic acetylcholine receptor antagonist.