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Ligand

NameCHEMBL1771238
Molecular formulaC28H27N5O
IUPAC nameN-(3-ethylphenyl)-4-(2-methylphenyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
Molecular weight449.558
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.4
SynonymsBDBM50343103
N-(3-ethylphenyl)-2-(pyridin-3-yl)-4-o-tolyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxamide
SCHEMBL13246187
Inchi KeyKWNIEYLXTCETIG-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H27N5O/c1-3-20-9-6-11-22(16-20)30-28(34)33-15-13-25-24(18-33)26(23-12-5-4-8-19(23)2)32-27(31-25)21-10-7-14-29-17-21/h4-12,14,16-17H,3,13,15,18H2,1-2H3,(H,30,34)
PubChem CID54581547
ChEMBLCHEMBL1771238
IUPHARN/A
BindingDB50343103
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
179980P2Y purinoceptor 14Q9ESG6P2ry14Mus musculus (Mouse)338

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