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Ligand

NameCHEMBL2331654
Molecular formulaC20H21F3N4O4
IUPAC name2-ethoxy-6-[3-[4-(trifluoromethoxy)phenyl]propanoyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-4-carboxamide
Molecular weight438.407
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP2.5
SynonymsBDBM50428103
Inchi KeyCXIGYWOTNSPHEH-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H21F3N4O4/c1-2-30-19-25-15-9-10-27(11-14(15)17(26-19)18(24)29)16(28)8-5-12-3-6-13(7-4-12)31-20(21,22)23/h3-4,6-7H,2,5,8-11H2,1H3,(H2,24,29)
PubChem CID71540174
ChEMBLCHEMBL2331654
IUPHARN/A
BindingDB50428103
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
52824G-protein coupled bile acid receptor 1Q8TDU6GPBAR1Homo sapiens (Human)330

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