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Ligand

NameSCHEMBL6012808
Molecular formulaC23H35N3O2
IUPAC name9-benzyl-1-butyl-3-(2-methylpropyl)-1,4,9-triazaspiro[5.5]undecane-2,5-dione
Molecular weight385.552
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.7
SynonymsBDBM50190522
(RS)-9-benzyl-1-butyl-3-isobutyl-1,4,9-triazaspiro[5.5]undecane-2,5-dione hydrochloride
CHEMBL1196504
1,4,9-Triazaspiro[5.5]undecane-2,5-dione, 1-butyl-3-(2-methylpropyl)-9-(phenylmethyl)-
9-benzyl-1-butyl-3-(2-methylpropyl)-1,4,9-triazaspiro[5.5]-undeca-2,5-dione hydrochloride
[ Show all ]
Inchi KeyAPZAJCZLYILDDW-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H35N3O2/c1-4-5-13-26-21(27)20(16-18(2)3)24-22(28)23(26)11-14-25(15-12-23)17-19-9-7-6-8-10-19/h6-10,18,20H,4-5,11-17H2,1-3H3,(H,24,28)
PubChem CID10159218
ChEMBLN/A
IUPHARN/A
BindingDB50190522
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
11470C-C chemokine receptor type 2P41597CCR2Homo sapiens (Human)374
11469C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352
11468C-X-C chemokine receptor type 4P61073CXCR4Homo sapiens (Human)352

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