alizapride   

GtoPdb Ligand ID: 11141

Synonyms: Limican® | Litican® | Nausilex® | Plitican® | Superan® | Vergentan®
alizapride is an approved drug
Compound class: Synthetic organic
Comment: Dopamine D2 receptor antagonist with prokinetic and antiemetic effects which can also be used in the treatment of nausea and vomiting, including postoperative nausea and vomiting.
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 83.14
Molecular weight 315.17
XLogP 1.53
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES C=CCN1CCCC1CNC(=O)c1cc2[nH]nnc2cc1OC
Isomeric SMILES C=CCN1CCCC1CNC(=O)c1cc2[nH]nnc2cc1OC
InChI InChI=1S/C16H21N5O2/c1-3-6-21-7-4-5-11(21)10-17-16(22)12-8-13-14(19-20-18-13)9-15(12)23-2/h3,8-9,11H,1,4-7,10H2,2H3,(H,17,22)(H,18,19,20)
InChI Key KSEYRUGYKHXGFW-UHFFFAOYSA-N
Classification
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name
6-methoxy-N-[(1-prop-2-enylpyrrolidin-2-yl)methyl]-2H-benzotriazole-5-carboxamide
International Nonproprietary Names
INN number INN
4823 alizapride
Synonyms
Limican® | Litican® | Nausilex® | Plitican® | Superan® | Vergentan®
Database Links
CAS Registry No. 59338-93-1
ChEMBL Ligand CHEMBL290194
GtoPdb PubChem SID 434122201
PubChem CID 135413504
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