vecuronium

Ligand id: 4002

Name: vecuronium

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 55.84
Molecular weight 557.43
XLogP 6.78
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (1999))
IUPAC Name
1-[(1S,2S,4S,5S,7S,10R,11S,13S,14R,15S)-5,14-bis(acetyloxy)-2,15-dimethyl-4-(piperidin-1-yl)tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-13-yl]-1-methylpiperidin-1-ium
International Nonproprietary Names
INN number INN
5100 vecuronium bromide
Synonyms
Norcuron® | ORG NC 45 / ORG-NC 45
Database Links
CAS Registry No. 86029-43-8 (source: Scifinder)
ChEMBL Ligand CHEMBL1201219
DrugBank Ligand DB01339
PubChem CID 39765
Search Google for chemical match using the InChIKey BGSZAXLLHYERSY-XQIGCQGXSA-N
Search Google for chemicals with the same backbone BGSZAXLLHYERSY
Search PubMed clinical trials vecuronium bromide
Search PubMed titles vecuronium bromide
Search PubMed titles/abstracts vecuronium bromide
Search UniChem for chemical match using the InChIKey BGSZAXLLHYERSY-XQIGCQGXSA-N
Search UniChem for chemicals with the same backbone BGSZAXLLHYERSY
Wikipedia Vecuronium
Comments
Approved as vecuronium bromide (PubChem CID 39764).
The neuromuscular blockade induced by vecuronium can be reversed by administering the selective relaxant binding agent (SRBA) sugammadex (PubChem CID 6918584, a.k.a. Bridion®, Org 25969).