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Ligand

NameSCHEMBL6114888
Molecular formulaC25H30BrNO5
IUPAC name6-[2-[4-[[4-bromo-3-(2-hydroxyethoxy)phenyl]methyl]piperidin-1-yl]ethyl]-3-hydroxy-2,3-dihydrochromen-4-one
Molecular weight504.421
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.8
SynonymsUS8778970, 5-4
CHEMBL3656909
BDBM126696
Inchi KeyACJLTODAAAIJTN-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H30BrNO5/c26-21-3-1-19(15-24(21)31-12-11-28)13-18-6-9-27(10-7-18)8-5-17-2-4-23-20(14-17)25(30)22(29)16-32-23/h1-4,14-15,18,22,28-29H,5-13,16H2
PubChem CID50914245
ChEMBLCHEMBL3656909
IUPHARN/A
BindingDB126696
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
16335-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422

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