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Ligand

NameCHEMBL495611
Molecular formulaC22H31N3O3
IUPAC name[5-(1-tert-butylpiperidin-4-yl)oxy-1H-indol-2-yl]-morpholin-4-ylmethanone
Molecular weight385.508
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.0
SynonymsBDBM50268948
(5-(1-tert-butylpiperidin-4-yloxy)-1H-indol-2-yl)(morpholino)methanone
Inchi KeyAWGXEGNEJAFGFA-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H31N3O3/c1-22(2,3)25-8-6-17(7-9-25)28-18-4-5-19-16(14-18)15-20(23-19)21(26)24-10-12-27-13-11-24/h4-5,14-15,17,23H,6-13H2,1-3H3
PubChem CID44185245
ChEMBLCHEMBL495611
IUPHARN/A
BindingDB50268948
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
16009Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
16010Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445

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