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Ligand

NameCHEMBL1258999
Molecular formulaC22H24FN3O2
IUPAC name1-benzofuran-3-yl-[4-fluoro-4-[[(5-methylpyridin-2-yl)methylamino]methyl]piperidin-1-yl]methanone
Molecular weight381.451
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP2.9
Synonymsbenzofuran-3-yl(4-fluoro-4-(((5-methylpyridin-2-yl)methylamino)methyl)piperidin-1-yl)methanone
SCHEMBL3979504
BDBM50328638
Inchi KeyGUOJBWOHCJIFQW-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H24FN3O2/c1-16-6-7-17(25-12-16)13-24-15-22(23)8-10-26(11-9-22)21(27)19-14-28-20-5-3-2-4-18(19)20/h2-7,12,14,24H,8-11,13,15H2,1H3
PubChem CID42606573
ChEMBLCHEMBL1258999
IUPHARN/A
BindingDB50328638
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1057835-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
1057865-hydroxytryptamine receptor 2AP50129HTR2ASus scrofa (Pig)470
105784D(1A) dopamine receptorP50130DRD1Sus scrofa (Pig)446
105782D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
105785D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
524593D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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