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Ligand

NameMLS000570445
Molecular formulaC25H20N2O3
IUPAC nameN-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylphenyl)quinoline-4-carboxamide
Molecular weight396.446
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.8
SynonymsCHEMBL1499276
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylphenyl)quinoline-4-carboxamide
HMS3319M15
REGID_for_CID_1220296
MolPort-001-490-244
[ Show all ]
Inchi KeyAVBFGEPJASDZCA-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H20N2O3/c1-16-6-8-17(9-7-16)22-15-20(19-4-2-3-5-21(19)27-22)25(28)26-18-10-11-23-24(14-18)30-13-12-29-23/h2-11,14-15H,12-13H2,1H3,(H,26,28)
PubChem CID1220296
ChEMBLCHEMBL1499276
IUPHARN/A
BindingDB42522
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
15151Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
15150Neuropeptide Y receptor type 1P25929NPY1RHomo sapiens (Human)384
15149Neuropeptide Y receptor type 2P49146NPY2RHomo sapiens (Human)381

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