(+)-sulpiride   Click here for help

GtoPdb Ligand ID: 960

Synonyms: R-(+)-sulpiride
Compound class: Synthetic organic
Comment: (+)-sulpiride is component of the approved drug sulpiride.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 110.11
Molecular weight 341.14
XLogP 0.62
No. Lipinski's rules broken 0
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Canonical SMILES CCN1CCCC1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N
Isomeric SMILES CCN1CCC[C@@H]1CNC(=O)c1cc(ccc1OC)S(=O)(=O)N
InChI InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)/t11-/m1/s1
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
2359 sulpiride
Synonyms Click here for help
Database Links Click here for help
Specialist databases
GPCRdb Ligand (+)-sulpiride
Other databases
BindingDB Ligand 81776
CAS Registry No. 23756-79-8 (source: SciFinder)
ChEMBL Ligand CHEMBL196677
DrugBank Ligand DB00391
GtoPdb PubChem SID 135651092
PubChem CID 643497
Search Google for chemical match using the InChIKey BGRJTUBHPOOWDU-LLVKDONJSA-N
Search Google for chemicals with the same backbone BGRJTUBHPOOWDU
Search PubMed clinical trials sulpiride
Search PubMed titles sulpiride
Search PubMed titles/abstracts sulpiride
UniChem Compound Search for chemical match using the InChIKey BGRJTUBHPOOWDU-LLVKDONJSA-N
UniChem Connectivity Search for chemical match using the InChIKey BGRJTUBHPOOWDU-LLVKDONJSA-N