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Ligand

NameCHEMBL2435929
Molecular formulaC25H20F7N3
IUPAC name2-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(2-fluorophenyl)pyridin-3-yl]methyl-propylamino]acetonitrile
Molecular weight495.445
Hydrogen bond acceptor10
Hydrogen bond donor0
XlogP6.6
SynonymsBDBM50441399
Inchi KeyCFFCQINDFYKHJG-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H20F7N3/c1-2-9-35(15-17-14-34-8-7-20(17)21-5-3-4-6-22(21)26)23(13-33)16-10-18(24(27,28)29)12-19(11-16)25(30,31)32/h3-8,10-12,14,23H,2,9,15H2,1H3
PubChem CID73350993
ChEMBLCHEMBL2435929
IUPHARN/A
BindingDB50441399
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
40585G-protein coupled bile acid receptor 1Q8TDU6GPBAR1Homo sapiens (Human)330

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