LEVOSULPIRIDE

/static/temp/default.svg Search structure
Synonyms
Status
Molecule Category Free-form
ATC N05AL07
UNII JTG7R315LK
EPA CompTox DTXSID0042583

Structure

InChI Key BGRJTUBHPOOWDU-NSHDSACASA-N
Smiles CCN1CCC[C@H]1CNC(=O)c1cc(S(N)(=O)=O)ccc1OC
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-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H23N3O4S
Molecular Weight 341.43
AlogP 0.56
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 6.0
Polar Surface Area 101.73
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 23.0

Pharmacology

Mechanism of Action Action Reference
Dopamine D2 receptor antagonist ANTAGONIST PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Lyase
- - - - 37.9-50
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Dopamine receptor
- 2e-08-233 - 6.9-120 -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Canis lupus familiaris
- 2e - - -
Rattus norvegicus
- - - 6.9-39 -

Target Conservation

Protein: Dopamine D2 receptor
Description: D(2) dopamine receptor
Organism : Homo sapiens
P14416 ENSG00000149295
Protein: Serotonin 4 (5-HT4) receptor
Description: 5-hydroxytryptamine receptor 4
Organism : Homo sapiens
Q13639 ENSG00000164270

Related Entries

Cross References

Resources Reference
ChEBI 64119
ChEMBL CHEMBL267044
DrugBank DB16021
DrugCentral 1577
FDA SRS JTG7R315LK
Guide to Pharmacology 958
PubChem 688272
SureChEMBL SCHEMBL70112
ZINC ZINC000000057008
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