YM49598

Ligand id: 2122

Name: YM49598

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 10
Topological polar surface area 29.54
Molecular weight 607.29
XLogP 10.08
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-[3-(3,4-dichlorophenyl)-3-[2-(1-methyl-4-phenylpiperidin-1-ium-1-yl)ethyl]piperidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone
Synonyms
YM-49598
Database Links
PubChem CID 10327625
Search Google for chemical match using the InChIKey QRSSYNAUQYYMPH-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QRSSYNAUQYYMPH
Search UniChem for chemical match using the InChIKey QRSSYNAUQYYMPH-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone QRSSYNAUQYYMPH