sarpogrelate

Ligand id: 210

Name: sarpogrelate

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 14
Topological polar surface area 85.3
Molecular weight 429.22
XLogP 4.51
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name
4-[1-dimethylamino-3-[2-[2-(3-methoxyphenyl)ethyl]phenoxy]propan-2-yl]oxy-4-oxobutanoic acid
International Nonproprietary Names
INN number INN
6611 sarpogrelate
Synonyms
Anplag® | LS-187,118 | MCI-9042
Database Links
BindingDB Ligand 50015571
CAS Registry No. 125926-17-2 (source: Scifinder)
ChEMBL Ligand CHEMBL52939
PubChem CID 5160
Search Google for chemical match using the InChIKey FFYNAVGJSYHHFO-UHFFFAOYSA-N
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Search UniChem for chemical match using the InChIKey FFYNAVGJSYHHFO-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone FFYNAVGJSYHHFO
Wikipedia Sarpogrelate
Comments
Sarpogrelate is a 5-HT2A/ 5-HT2B receptor antagonist which blocks serotonin-induced platelet aggregation.