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Ligand

NameCHEMBL51234
Molecular formulaC27H22ClN2O7S-
IUPAC name(Z)-2-(2,1,3-benzothiadiazol-5-yl)-4-(3-chloro-4-methoxyphenyl)-4-oxo-3-[(3,4,5-trimethoxyphenyl)methyl]but-2-enoate
Molecular weight553.99
Hydrogen bond acceptor10
Hydrogen bond donor0
XlogP6.0
SynonymsSodium; (Z)-2-benzo[1,2,5]thiadiazol-5-yl-4-(3-chloro-4-methoxy-phenyl)-4-oxo-3-(3,4,5-trimethoxy-benzyl)-but-2-enoate
BDBM50070886
Inchi KeyGAKQDXZHZRHZNZ-ULJHMMPZSA-M
Inchi IDInChI=1S/C27H23ClN2O7S/c1-34-21-8-6-16(12-18(21)28)25(31)17(9-14-10-22(35-2)26(37-4)23(11-14)36-3)24(27(32)33)15-5-7-19-20(13-15)30-38-29-19/h5-8,10-13H,9H2,1-4H3,(H,32,33)/p-1/b24-17-
PubChem CID91930982
ChEMBLN/A
IUPHARN/A
BindingDB50070886
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
91697Endothelin receptor type BP35463EDNRBSus scrofa (Pig)443
91696Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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