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Ligand

NameCHEMBL536754
Molecular formulaC32H44ClN3O4
IUPAC name(3R)-1-butyl-3-[(R)-cyclohexyl(hydroxy)methyl]-9-[(4-phenoxyphenyl)methyl]-1,4,9-triazaspiro[5.5]undecane-2,5-dione;hydrochloride
Molecular weight570.171
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogPNone
SynonymsSCHEMBL5356840
Inchi KeyAOOTYIRLUTVCBQ-PQQSRXGVSA-N
Inchi IDInChI=1S/C32H43N3O4.ClH/c1-2-3-20-35-30(37)28(29(36)25-10-6-4-7-11-25)33-31(38)32(35)18-21-34(22-19-32)23-24-14-16-27(17-15-24)39-26-12-8-5-9-13-26;/h5,8-9,12-17,25,28-29,36H,2-4,6-7,10-11,18-23H2,1H3,(H,33,38);1H/t28-,29-;/m1./s1
PubChem CID23577403
ChEMBLCHEMBL536754
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
10453C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352

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