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Ligand

NameCHEMBL334092
Molecular formulaC20H31N5O3S
IUPAC name7,7-dioxo-8-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-7lambda6-thia-8-azaspiro[4.5]decan-9-one
Molecular weight421.56
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP1.6
SynonymsN/A
Inchi KeyBKQQMTMLYHASKD-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H31N5O3S/c26-18-16-20(6-1-2-7-20)17-29(27,28)25(18)11-4-3-10-23-12-14-24(15-13-23)19-21-8-5-9-22-19/h5,8-9H,1-4,6-7,10-17H2
PubChem CID44345377
ChEMBLCHEMBL334092
IUPHARN/A
BindingDBN/A
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
260145-hydroxytryptamine receptor 1DP28221HTR1DHomo sapiens (Human)377
260155-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471

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