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Ligand

NameCHEMBL50722
Molecular formulaC25H36N2O5
IUPAC name8-[3-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-propylamino]propoxy]-8-azaspiro[4.5]decane-7,9-dione
Molecular weight444.572
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.3
Synonyms8-{3-[(5-Methoxy-chroman-3-yl)-propyl-amino]-propoxy}-8-aza-spiro[4.5]decane-7,9-dione; compound with oxalic acid
BDBM50036865
CHEMBL28287
Inchi KeyAHHHNGSCPKOKHX-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H36N2O5/c1-3-12-26(19-15-20-21(30-2)8-6-9-22(20)31-18-19)13-7-14-32-27-23(28)16-25(17-24(27)29)10-4-5-11-25/h6,8-9,19H,3-5,7,10-18H2,1-2H3
PubChem CID10321248
ChEMBLCHEMBL28287
IUPHARN/A
BindingDB50036865
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
55465-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
55455-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
55425-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
5548Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
5544Alpha-2A adrenergic receptorQ28838ADRA2ABos taurus (Bovine)452
5547D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
5543D(2) dopamine receptorP20288DRD2Bos taurus (Bovine)444

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