physostigmine

Ligand id: 6598

Name: physostigmine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 44.81
Molecular weight 275.16
XLogP 2.09
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Natural product or derivative
Approved drug? Yes
IUPAC Name
[(3aR,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-yl] N-methylcarbamate
Synonyms
Antilirium® | eserine | physostigmine salicylate
Database Links
CAS Registry No. 57-47-6
ChEBI CHEBI:27953
ChEMBL Ligand CHEMBL94
DrugBank Ligand DB00981
GtoPdb PubChem SID 178103211
PubChem CID 5983
Search Google for chemical match using the InChIKey PIJVFDBKTWXHHD-HIFRSBDPSA-N
Search Google for chemicals with the same backbone PIJVFDBKTWXHHD
Search UniChem for chemical match using the InChIKey PIJVFDBKTWXHHD-HIFRSBDPSA-N
Search UniChem for chemicals with the same backbone PIJVFDBKTWXHHD
Wikipedia Physostigmine
Comments
Physostigmine, originally isolated from the Calabar bean, is a parasympathomimetic alkaloid, acting as a reversible cholinesterase inhibitor (the enzyme responsible for the breakdown of acetylcholine in the synaptic cleft of the neuromuscular junction).