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Ligand

NameCHEMBL3717068
Molecular formulaC25H17F3N4O4S2
IUPAC name2-methoxy-6-[6-methoxy-4-[[2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]methoxy]-1-benzofuran-2-yl]imidazo[2,1-b][1,3,4]thiadiazole
Molecular weight558.55
Hydrogen bond acceptor12
Hydrogen bond donor0
XlogP6.3
SynonymsUS9688695, 17
BDBM175984
SCHEMBL15356449
Inchi KeyBCADWXHPHVPWJY-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H17F3N4O4S2/c1-33-16-7-19(35-11-15-12-37-22(29-15)13-4-3-5-14(6-13)25(26,27)28)17-9-21(36-20(17)8-16)18-10-32-23(30-18)38-24(31-32)34-2/h3-10,12H,11H2,1-2H3
PubChem CID89878649
ChEMBLCHEMBL3717068
IUPHARN/A
BindingDB175984
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.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
522051Proteinase-activated receptor 4Q96RI0F2RL3Homo sapiens (Human)385

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