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Ligand

NameCHEMBL130040
Molecular formulaC19H27NO4
IUPAC name(1-butylpiperidin-4-yl)methyl 2,3-dihydro-1,4-benzodioxine-5-carboxylate
Molecular weight333.428
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.5
SynonymsRo-116-0086
SCHEMBL14905735
RO 116 0086
(1-butylpiperidin-4-yl)methyl 2,3-dihydro-1,4-benzodioxine-8-carboxylate
RS 116 0086
[ Show all ]
Inchi KeyYGXXLNHVBNARBP-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H27NO4/c1-2-3-9-20-10-7-15(8-11-20)14-24-19(21)16-5-4-6-17-18(16)23-13-12-22-17/h4-6,15H,2-3,7-14H2,1H3
PubChem CID10404587
ChEMBLCHEMBL130040
IUPHAR251
BindingDB50422009
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
4099625-hydroxytryptamine receptor 4O70528HTR4Cavia porcellus (Guinea pig)388
5553305-hydroxytryptamine receptor 4P97288Htr4Mus musculus (Mouse)388

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