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Ligand

NameCHEMBL3233865
Molecular formulaC30H32N2O4
IUPAC name2-[1-[3-[(3-phenyl-2,3-dihydro-1,4-benzodioxin-2-yl)methoxy]propyl]piperidin-4-yl]-1,3-benzoxazole
Molecular weight484.596
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP5.6
SynonymsBDBM50009383
Inchi KeyAGKFWTDVDBIRHM-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H32N2O4/c1-2-9-22(10-3-1)29-28(34-26-13-6-7-14-27(26)35-29)21-33-20-8-17-32-18-15-23(16-19-32)30-31-24-11-4-5-12-25(24)36-30/h1-7,9-14,23,28-29H,8,15-21H2
PubChem CID85471166
ChEMBLCHEMBL3233865
IUPHARN/A
BindingDB50009383
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
49495-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
49485-hydroxytryptamine receptor 2AP14842Htr2aRattus norvegicus (Rat)471

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