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Ligand

NameCHEMBL131173
Molecular formulaC35H43N3O5S
IUPAC name3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methyl-N-(2-methyloctyl)indole-5-carboxamide
Molecular weight617.805
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP7.8
SynonymsN-[(2-Methylphenyl)sulfonyl]-3-methoxy-4-[[1-methyl-5-[(2-methyloctyl)carbamoyl]-1H-indol-3-yl]methyl]benzamide
Inchi KeyBNGMIHWEUCAUQB-UHFFFAOYSA-N
Inchi IDInChI=1S/C35H43N3O5S/c1-6-7-8-9-12-24(2)22-36-34(39)27-17-18-31-30(20-27)29(23-38(31)4)19-26-15-16-28(21-32(26)43-5)35(40)37-44(41,42)33-14-11-10-13-25(33)3/h10-11,13-18,20-21,23-24H,6-9,12,19,22H2,1-5H3,(H,36,39)(H,37,40)
PubChem CID10100380
ChEMBLCHEMBL131173
IUPHARN/A
BindingDBN/A
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
28095Cysteinyl leukotriene receptor 1Q2NNR5CYSLTR1Cavia porcellus (Guinea pig)340

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