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Ligand

NameCHEMBL2440908
Molecular formulaC42H59N11O8
IUPAC nameN'-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-N-[2-[[N'-[(4R)-5-[[4-[(carbamoylamino)methyl]phenyl]methylamino]-4-[(2,2-diphenylacetyl)amino]-5-oxopentyl]carbamimidoyl]carbamoylamino]ethyl]butanediamide
Molecular weight846.003
Hydrogen bond acceptor10
Hydrogen bond donor10
XlogP-0.8
SynonymsBDBM50442548
CHEMBL3040698
Inchi KeyHZWRNZTXCPTOQF-UUWRZZSWSA-N
Inchi IDInChI=1S/C42H59N11O8/c43-19-24-60-26-27-61-25-23-47-36(55)18-17-35(54)46-21-22-49-42(59)53-40(44)48-20-7-12-34(38(56)50-28-30-13-15-31(16-14-30)29-51-41(45)58)52-39(57)37(32-8-3-1-4-9-32)33-10-5-2-6-11-33/h1-6,8-11,13-16,34,37H,7,12,17-29,43H2,(H,46,54)(H,47,55)(H,50,56)(H,52,57)(H3,45,51,58)(H4,44,48,49,53,59)/t34-/m1/s1
PubChem CID73352596
ChEMBLN/A
IUPHARN/A
BindingDB50442548
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
128099Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384
128098Neuropeptide Y receptor type 4P50391NPY4RHomo sapiens (Human)375

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