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Ligand

NameCHEMBL3361431
Molecular formulaC22H29BrN6O
IUPAC nameN-[[4-anilino-1-[(4-bromophenyl)methyl]piperidin-4-yl]methyl]-2-(diaminomethylideneamino)acetamide
Molecular weight473.419
Hydrogen bond acceptor4
Hydrogen bond donor4
XlogP2.5
SynonymsBDBM50029128
Inchi KeyQYTUZIWLELWSHU-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H29BrN6O/c23-18-8-6-17(7-9-18)15-29-12-10-22(11-13-29,28-19-4-2-1-3-5-19)16-27-20(30)14-26-21(24)25/h1-9,28H,10-16H2,(H,27,30)(H4,24,25,26)
PubChem CID118724991
ChEMBLCHEMBL3361431
IUPHARN/A
BindingDB50029128
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
453156Neuropeptide FF receptor 1Q9GZQ6NPFFR1Homo sapiens (Human)430
453155Neuropeptide FF receptor 2Q9Y5X5NPFFR2Homo sapiens (Human)522

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