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Ligand

NameCHEMBL3361412
Molecular formulaC35H52N6O5
IUPAC nametert-butyl N-[N'-[5-[(4-anilino-1-benzylpiperidin-4-yl)methylamino]-5-oxopentyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate
Molecular weight636.838
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP6.5
SynonymsBDBM50029113
Inchi KeyAHHXHDPMFIEXGP-UHFFFAOYSA-N
Inchi IDInChI=1S/C35H52N6O5/c1-33(2,3)45-31(43)38-30(39-32(44)46-34(4,5)6)36-22-14-13-19-29(42)37-26-35(40-28-17-11-8-12-18-28)20-23-41(24-21-35)25-27-15-9-7-10-16-27/h7-12,15-18,40H,13-14,19-26H2,1-6H3,(H,37,42)(H2,36,38,39,43,44)
PubChem CID118724973
ChEMBLCHEMBL3361412
IUPHARN/A
BindingDB50029113
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
441916Neuropeptide FF receptor 1Q9GZQ6NPFFR1Homo sapiens (Human)430
441917Neuropeptide FF receptor 2Q9Y5X5NPFFR2Homo sapiens (Human)522

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