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Ligand

NameCHEMBL3719223
Molecular formulaC32H31N5O6S2
IUPAC name4-[4-[4-[[6-methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)-1-benzofuran-4-yl]oxymethyl]-1,3-thiazol-2-yl]oxan-4-yl]-N,N-dimethylbenzamide
Molecular weight645.749
Hydrogen bond acceptor11
Hydrogen bond donor0
XlogP5.3
Synonyms4-(4-(4-(((6-Methoxy-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)benzofuran-4-yl)oxy)methyl)thiazol-2-yl)tetrahydro-2H-pyran-4-yl)-N,N-dimethylbenzamide
US9688695, 161
BDBM176128
CXZHQWBVEDJXCG-UHFFFAOYSA-N
SCHEMBL15348988
Inchi KeyCXZHQWBVEDJXCG-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H31N5O6S2/c1-36(2)28(38)19-5-7-20(8-6-19)32(9-11-41-12-10-32)29-33-21(18-44-29)17-42-25-13-22(39-3)14-26-23(25)15-27(43-26)24-16-37-30(34-24)45-31(35-37)40-4/h5-8,13-16,18H,9-12,17H2,1-4H3
PubChem CID89872973
ChEMBLCHEMBL3719223
IUPHARN/A
BindingDB176128
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
523089Proteinase-activated receptor 4Q96RI0F2RL3Homo sapiens (Human)385

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