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Ligand

NameCHEMBL1771242
Molecular formulaC28H25N5O2
IUPAC nameN-(3-acetylphenyl)-4-(2-methylphenyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
Molecular weight463.541
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.3
SynonymsBDBM50343107
N-(3-acetylphenyl)-2-(pyridin-3-yl)-4-o-tolyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxamide
Inchi KeyUODRBXKKSNKBSU-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H25N5O2/c1-18-7-3-4-11-23(18)26-24-17-33(28(35)30-22-10-5-8-20(15-22)19(2)34)14-12-25(24)31-27(32-26)21-9-6-13-29-16-21/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,30,35)
PubChem CID54586409
ChEMBLCHEMBL1771242
IUPHARN/A
BindingDB50343107
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
341501P2Y purinoceptor 14Q9ESG6P2ry14Mus musculus (Mouse)338

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