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Ligand

NameCHEMBL374059
Molecular formulaC25H29FN2O3
IUPAC name5-[[4-[1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]methyl]-2-fluorobenzoic acid
Molecular weight424.516
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP1.6
SynonymsBDBM50156889
5-{4-[1-(2-ethoxyethyl)-1H-indol-3-yl]piperidin-1-ylmethyl}-2-fluorobenzoic acid
Inchi KeyWTIORDULYOQUBE-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H29FN2O3/c1-2-31-14-13-28-17-22(20-5-3-4-6-24(20)28)19-9-11-27(12-10-19)16-18-7-8-23(26)21(15-18)25(29)30/h3-8,15,17,19H,2,9-14,16H2,1H3,(H,29,30)
PubChem CID11247290
ChEMBLCHEMBL374059
IUPHARN/A
BindingDB50156889
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
381958Histamine H1 receptorP70174Hrh1Mus musculus (Mouse)488
381960Histamine H1 receptorP31389HRH1Cavia porcellus (Guinea pig)488
381959Histamine H2 receptorP25021HRH2Homo sapiens (Human)359

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