mosapride   Click here for help

GtoPdb Ligand ID: 242

Approved drug
mosapride is an approved drug
Compound class: Synthetic organic
Comment: Marketed formulations contain mosapride citrate (PubChem CID 119583).
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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 8
Topological polar surface area 76.82
Molecular weight 421.16
XLogP 2.93
No. Lipinski's rules broken 0
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Canonical SMILES CCOc1cc(N)c(cc1C(=O)NCC1OCCN(C1)Cc1ccc(cc1)F)Cl
Isomeric SMILES CCOc1cc(N)c(cc1C(=O)NCC1OCCN(C1)Cc1ccc(cc1)F)Cl
InChI InChI=1S/C21H25ClFN3O3/c1-2-28-20-10-19(24)18(22)9-17(20)21(27)25-11-16-13-26(7-8-29-16)12-14-3-5-15(23)6-4-14/h3-6,9-10,16H,2,7-8,11-13,24H2,1H3,(H,25,27)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
6855 mosapride
Database Links Click here for help
Specialist databases
GPCRdb Ligand mosapride
Other databases
BindingDB Ligand 50011327
CAS Registry No. 112885-41-3 (source: Scifinder)
ChEMBL Ligand CHEMBL60889
DrugCentral Ligand 1848
GtoPdb PubChem SID 135650625
PubChem CID 119584
Search Google for chemical match using the InChIKey YPELFRMCRYSPKZ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone YPELFRMCRYSPKZ
Search PubMed clinical trials mosapride
Search PubMed titles mosapride
Search PubMed titles/abstracts mosapride
UniChem Compound Search for chemical match using the InChIKey YPELFRMCRYSPKZ-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey YPELFRMCRYSPKZ-UHFFFAOYSA-N
Wikipedia Mosapride