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Ligand

NameCHEMBL50370
Molecular formulaC31H33N3O5S
IUPAC nameN-(benzenesulfonyl)-4-[[5-[(2-cyclopentylacetyl)amino]-1-methylindol-3-yl]methyl]-3-methoxybenzamide
Molecular weight559.681
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP5.6
Synonyms4-[5-(Cyclopentylacetylamino)-1-methyl-1H-indol-3-ylmethyl]-3-methoxy-N-(phenylsulfonyl)benzamide
SCHEMBL4468802
BDBM50015528
N-[3-(4-Benzenesulfonylaminocarbonyl-2-methoxy-benzyl)-1-methyl-1H-indol-5-yl]-2-cyclopentyl-acetamide
Inchi KeyCVTDNWBPWCXPFN-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H33N3O5S/c1-34-20-24(27-19-25(14-15-28(27)34)32-30(35)16-21-8-6-7-9-21)17-22-12-13-23(18-29(22)39-2)31(36)33-40(37,38)26-10-4-3-5-11-26/h3-5,10-15,18-21H,6-9,16-17H2,1-2H3,(H,32,35)(H,33,36)
PubChem CID14626819
ChEMBLCHEMBL50370
IUPHARN/A
BindingDB50015528
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
51768Cysteinyl leukotriene receptor 1Q2NNR5CYSLTR1Cavia porcellus (Guinea pig)340

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