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Ligand

NameCHEMBL2037529
Molecular formulaC20H23N5OS
IUPAC name1-(1,3-benzothiazol-2-yl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)pentan-1-one
Molecular weight381.498
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP3.3
SynonymsBDBM50384965
Inchi KeyDYFDYWXRTZSUEM-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H23N5OS/c26-17(19-23-16-6-1-2-8-18(16)27-19)7-3-4-11-24-12-14-25(15-13-24)20-21-9-5-10-22-20/h1-2,5-6,8-10H,3-4,7,11-15H2
PubChem CID60165411
ChEMBLCHEMBL2037529
IUPHARN/A
BindingDB50384965
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
719445-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
719415-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
719425-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
71945D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
71943D(4) dopamine receptorP30729Drd4Rattus norvegicus (Rat)387

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