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Ligand

NameCHEMBL3715995
Molecular formulaC24H22F3N5O6S3
IUPAC name2-methoxy-6-[6-methoxy-4-[[2-[1-(trifluoromethylsulfonyl)piperidin-4-yl]-1,3-thiazol-4-yl]methoxy]-1-benzofuran-2-yl]imidazo[2,1-b][1,3,4]thiadiazole
Molecular weight629.644
Hydrogen bond acceptor15
Hydrogen bond donor0
XlogP4.8
SynonymsBDBM176081
SCHEMBL15357167
US9688695, 114
Inchi KeyBDZNBNNJQRTJAR-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H22F3N5O6S3/c1-35-15-7-18(16-9-20(38-19(16)8-15)17-10-32-22(29-17)40-23(30-32)36-2)37-11-14-12-39-21(28-14)13-3-5-31(6-4-13)41(33,34)24(25,26)27/h7-10,12-13H,3-6,11H2,1-2H3
PubChem CID72191506
ChEMBLCHEMBL3715995
IUPHARN/A
BindingDB176081
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
522089Proteinase-activated receptor 4Q96RI0F2RL3Homo sapiens (Human)385

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