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Ligand

NameBDBM85535
Molecular formulaC43H54N6O4S
IUPAC nameN-[3-[4-[N'-[[4-[(dimethylamino)methyl]cyclohexyl]methyl]carbamimidoyl]phenyl]-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]-2-(naphthalen-2-ylsulfonylamino)-3-phenylpropanamide
Molecular weight751.003
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP6.2
SynonymsCAS_5312150
L013573
L024002
Inchi KeyGKKPXBHNFVDHAQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C43H54N6O4S/c1-48(2)30-34-16-14-33(15-17-34)29-45-41(44)36-20-18-32(19-21-36)27-40(43(51)49-24-8-9-25-49)46-42(50)39(26-31-10-4-3-5-11-31)47-54(52,53)38-23-22-35-12-6-7-13-37(35)28-38/h3-7,10-13,18-23,28,33-34,39-40,47H,8-9,14-17,24-27,29-30H2,1-2H3,(H2,44,45)(H,46,50)
PubChem CID20725594
ChEMBLN/A
IUPHARN/A
BindingDB85535
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
98756Neuropeptide Y receptor type 1Q9WVD0NPY1RCavia porcellus (Guinea pig)383
98757Neuropeptide Y receptor type 1P21555Npy1rRattus norvegicus (Rat)382

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