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Ligand

NameCHEMBL133375
Molecular formulaC28H40N2O4
IUPAC name8-[4-(1'-propylspiro[2,4-dihydrochromene-3,2'-pyrrolidine]-5-yl)oxybutyl]-8-azaspiro[4.5]decane-7,9-dione
Molecular weight468.638
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.9
Synonyms8-[4-[[1'-Propylspiro[2H-1-benzopyran-3(4H),2'-pyrrolidin]-5-yl]oxy]butyl]-8-azaspiro[4.5]decane-7,9-dione
8-{4-[1''-propylspiro[3,4-dihydro-2H-chromene-3,2''-(tetrahydro-1''H-pyrrole)]-5-yloxy]butyl}-8-azaspiro[4.5]decane-7,9-dione
BDBM50054155
SCHEMBL8556860
Inchi KeyCVBMSXGNWVNTDT-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H40N2O4/c1-2-14-29-15-8-13-28(29)18-22-23(9-7-10-24(22)34-21-28)33-17-6-5-16-30-25(31)19-27(20-26(30)32)11-3-4-12-27/h7,9-10H,2-6,8,11-21H2,1H3
PubChem CID10838030
ChEMBLCHEMBL133375
IUPHARN/A
BindingDB50054155
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
513465-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
513455-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386

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