ranolazine   Click here for help

GtoPdb Ligand ID: 7291

Synonyms: CVT-303 | Ranexa® | RS-43285 | RS-43285-003
Approved drug
ranolazine is an approved drug (FDA (2006), EMA (2008))
Compound class: Synthetic organic
Comment: The mechanism of action of ranolazine is largely unknown, but may have some antianginal effects by inhibition of the late sodium current in cardiac cells.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 77.76
Molecular weight 427.25
XLogP 1.9
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES COc1ccccc1OCC(CN1CCN(CC1)CC(=Nc1c(C)cccc1C)O)O
Isomeric SMILES COc1ccccc1OCC(CN1CCN(CC1)CC(=Nc1c(C)cccc1C)O)O
InChI InChI=1S/C24H33N3O4/c1-18-7-6-8-19(2)24(18)25-23(29)16-27-13-11-26(12-14-27)15-20(28)17-31-22-10-5-4-9-21(22)30-3/h4-10,20,28H,11-17H2,1-3H3,(H,25,29)
InChI Key XKLMZUWKNUAPSZ-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (2006), EMA (2008))
IUPAC Name Click here for help
N-(2,6-dimethylphenyl)-2-{4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl}ethanimidic acid
International Nonproprietary Names Click here for help
INN number INN
5946 ranolazine
Synonyms Click here for help
CVT-303 | Ranexa® | RS-43285 | RS-43285-003
Database Links Click here for help
CAS Registry No. 95635-55-5
ChEMBL Ligand CHEMBL1404
DrugBank Ligand DB00243
DrugCentral Ligand 2359
GtoPdb PubChem SID 178103865
PubChem CID 56959
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Wikipedia Ranolazine