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Ligand

NameBDBM50049190
Molecular formulaC35H38N4O5S
IUPAC namebutyl N-[2-[4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-4-(3-methoxyphenyl)phenyl]sulfonylcarbamate
Molecular weight626.772
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP7.5
Synonyms4''''-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-3-methoxy-[1,1'';3'',1'''']terphenyl-4''-sulfonic acid butyloxycarbonylamide(L-163491)
N-Butyloxycarbonyl-4''-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-5-(3-methoxy-benzyl)-biphenyl-2-sulfonic acid amide
Inchi KeyFIQSIBCUVDUQMM-UHFFFAOYSA-N
Inchi IDInChI=1S/C35H38N4O5S/c1-6-8-18-44-35(40)38-45(41,42)31-17-16-28(27-10-9-11-29(20-27)43-5)21-30(31)26-14-12-25(13-15-26)22-39-32(7-2)37-33-23(3)19-24(4)36-34(33)39/h9-17,19-21H,6-8,18,22H2,1-5H3,(H,38,40)
PubChem CID44372993
ChEMBLN/A
IUPHARN/A
BindingDB50049190
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
79306Type-2 angiotensin II receptorP50052AGTR2Homo sapiens (Human)363

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