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Ligand

NameGTPL9078
Molecular formulaC24H22FN3O
IUPAC nameN-(4-fluoro-2-methylphenyl)-3-methyl-N-[(2-methyl-1H-indol-4-yl)methyl]pyridine-4-carboxamide
Molecular weight387.458
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.7
Synonymscompound 15 [PMID: 25411721]
N-(4-fluoro-2-methylphenyl)-3-methyl-N-[(2-methyl-1H-indol-4-yl)methyl]pyridine-4-carboxamide
example 252 [WO2007110237]
SCHEMBL3064357
Inchi KeyFMASTMURQSHELY-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H22FN3O/c1-15-11-19(25)7-8-23(15)28(24(29)20-9-10-26-13-16(20)2)14-18-5-4-6-22-21(18)12-17(3)27-22/h4-13,27H,14H2,1-3H3
PubChem CID60166172
ChEMBLN/A
IUPHAR9078
BindingDBN/A
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
553673G-protein coupled bile acid receptor 1Q80SS6Gpbar1Mus musculus (Mouse)329
553674G-protein coupled bile acid receptor 1Q8TDU6GPBAR1Homo sapiens (Human)330

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