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Ligand

NameCHEMBL96847
Molecular formulaC26H29N3O6S
IUPAC name2-(1,3-benzodioxol-5-yl)-2-(5-methyl-6-oxo-3-propylpyridazin-1-yl)-N-(4-propan-2-ylphenyl)sulfonylacetamide
Molecular weight511.593
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.1
SynonymsBDBM50290951
N-[2-Benzo[1,3]dioxol-5-yl-2-(5-methyl-6-oxo-3-propyl-6H-pyridazin-1-yl)-acetyl]-4-isopropyl-benzenesulfonamide
Inchi KeyABGOGTPZZDQRQT-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H29N3O6S/c1-5-6-20-13-17(4)26(31)29(27-20)24(19-9-12-22-23(14-19)35-15-34-22)25(30)28-36(32,33)21-10-7-18(8-11-21)16(2)3/h7-14,16,24H,5-6,15H2,1-4H3,(H,28,30)
PubChem CID44327237
ChEMBLCHEMBL96847
IUPHARN/A
BindingDB50290951
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
843Endothelin receptor type BP35463EDNRBSus scrofa (Pig)443
842Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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