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Ligand

NameMLS000032393
Molecular formulaC26H26N6O3
IUPAC name3-[[[1-(furan-2-ylmethyl)tetrazol-5-yl]methyl-[(2-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-2-one
Molecular weight470.533
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.9
Synonymscid_647823
ZINC8617373
3-[[[1-(2-furanylmethyl)-5-tetrazolyl]methyl-[(2-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-2-one
ASN 05303840
3-[[[1-(furan-2-ylmethyl)tetrazol-5-yl]methyl-[(2-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-2-one
[ Show all ]
Inchi KeyBMDSAZDIDMDPRU-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H26N6O3/c1-18-9-10-23-20(12-18)13-21(26(33)27-23)15-31(14-19-6-3-4-8-24(19)34-2)17-25-28-29-30-32(25)16-22-7-5-11-35-22/h3-13H,14-17H2,1-2H3,(H,27,33)
PubChem CID647823
ChEMBLCHEMBL1608455
IUPHARN/A
BindingDB42408
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
27378Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
27380Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
27381Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384
27382Neuropeptide Y receptor type 2P49146NPY2RHomo sapiens (Human)381
27379Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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