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Ligand

NameCHEMBL3746851
Molecular formulaC34H38F3N9O6
IUPAC name(2R)-5-[[amino-[(1-methyltriazol-4-yl)methylcarbamoylamino]methylidene]amino]-2-[(2,2-diphenylacetyl)amino]-N-[(4-hydroxyphenyl)methyl]pentanamide;2,2,2-trifluoroacetic acid
Molecular weight725.73
Hydrogen bond acceptor12
Hydrogen bond donor7
XlogPNone
SynonymsN/A
Inchi KeySSJHOWOSZWKADG-HZPIKELBSA-N
Inchi IDInChI=1S/C32H37N9O4.C2HF3O2/c1-41-21-25(39-40-41)20-36-32(45)38-31(33)34-18-8-13-27(29(43)35-19-22-14-16-26(42)17-15-22)37-30(44)28(23-9-4-2-5-10-23)24-11-6-3-7-12-24;3-2(4,5)1(6)7/h2-7,9-12,14-17,21,27-28,42H,8,13,18-20H2,1H3,(H,35,43)(H,37,44)(H4,33,34,36,38,45);(H,6,7)/t27-;/m1./s1
PubChem CID127041908
ChEMBLCHEMBL3746851
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
530603Neuropeptide FF receptor 1Q9GZQ6NPFFR1Homo sapiens (Human)430
530607Neuropeptide FF receptor 2Q9Y5X5NPFFR2Homo sapiens (Human)522
530602Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384
530605Neuropeptide Y receptor type 2P49146NPY2RHomo sapiens (Human)381
530606Neuropeptide Y receptor type 4P50391NPY4RHomo sapiens (Human)375
530604Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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