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Ligand

NameSCHEMBL2774146
Molecular formulaC32H24F2N4O6S
IUPAC name1-[[2,6-difluoro-4-[2-(5-oxo-4H-1,2,4-oxadiazol-3-yl)phenyl]phenyl]methyl]-6-ethyl-3-[2-(4-methoxyphenyl)-2-oxoethyl]thieno[2,3-d]pyrimidine-2,4-dione
Molecular weight630.623
Hydrogen bond acceptor10
Hydrogen bond donor1
XlogP5.9
SynonymsSCHEMBL13311615
AMDWDZCCHMYHJH-UHFFFAOYSA-N
CHEMBL3640162
1-{[3,5-difluoro-2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}-6-ethyl-3-[2-(4-methoxyphenyl)-2-oxoethyl]thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
US8501750, 197
[ Show all ]
Inchi KeyAMDWDZCCHMYHJH-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H24F2N4O6S/c1-3-20-14-23-29(40)37(16-27(39)17-8-10-19(43-2)11-9-17)32(42)38(30(23)45-20)15-24-25(33)12-18(13-26(24)34)21-6-4-5-7-22(21)28-35-31(41)44-36-28/h4-14H,3,15-16H2,1-2H3,(H,35,36,41)
PubChem CID136052332
ChEMBLCHEMBL3640162
IUPHARN/A
BindingDB99984
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8787Type-1 angiotensin II receptorP30556AGTR1Homo sapiens (Human)359

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