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Ligand

NameCHEMBL2037518
Molecular formulaC22H24N2OS
IUPAC name1-(1,3-benzothiazol-2-yl)-4-(4-phenylpiperidin-1-yl)butan-1-one
Molecular weight364.507
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP5.0
SynonymsBDBM50384959
Inchi KeyIAMJESJLDAFTKX-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H24N2OS/c25-20(22-23-19-9-4-5-11-21(19)26-22)10-6-14-24-15-12-18(13-16-24)17-7-2-1-3-8-17/h1-5,7-9,11,18H,6,10,12-16H2
PubChem CID60165541
ChEMBLCHEMBL2037518
IUPHARN/A
BindingDB50384959
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1285235-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
1285245-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
1285255-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
128527D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
128526D(4) dopamine receptorP30729Drd4Rattus norvegicus (Rat)387

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