domperidone   Click here for help

GtoPdb Ligand ID: 965

Synonyms: Motilium® | Nauzelin® | R-33812
Approved drug
domperidone is an approved drug
Compound class: Synthetic organic
Comment: Domperidone is an orally active, peripherally acting and selective antagonist of dopamine D2 and D3 receptors.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 78.82
Molecular weight 425.16
XLogP 2.37
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2
Isomeric SMILES Clc1ccc2c(c1)[nH]c(=O)n2C1CCN(CC1)CCCn1c(=O)[nH]c2c1cccc2
InChI InChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)
InChI Key FGXWKSZFVQUSTL-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name Click here for help
6-chloro-3-[1-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]piperidin-4-yl]-1H-benzimidazol-2-one
International Nonproprietary Names Click here for help
INN number INN
4110 domperidone
Synonyms Click here for help
Motilium® | Nauzelin® | R-33812
Database Links Click here for help
BindingDB Ligand 50241107
CAS Registry No. 57808-66-9
ChEBI CHEBI:464745
ChEMBL Ligand CHEMBL219916
DrugBank Ligand DB01184
DrugCentral Ligand 945
GtoPdb PubChem SID 135650206
PubChem CID 3151
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Wikipedia Domperidone

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Tocris
Domperidone
Cat. No. 2536