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Ligand

NameCHEMBL1771245
Molecular formulaC28H25F2N5O
IUPAC nameN-[3-(1,1-difluoroethyl)phenyl]-4-(2-methylphenyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
Molecular weight485.539
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.4
SynonymsBDBM50343110
N-(3-(1,1-difluoroethyl)phenyl)-2-(pyridin-3-yl)-4-o-tolyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxamide
SCHEMBL13246201
Inchi KeyQCMKJUXGMZJXGD-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H25F2N5O/c1-18-7-3-4-11-22(18)25-23-17-35(27(36)32-21-10-5-9-20(15-21)28(2,29)30)14-12-24(23)33-26(34-25)19-8-6-13-31-16-19/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,32,36)
PubChem CID54582546
ChEMBLCHEMBL1771245
IUPHARN/A
BindingDB50343110
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
274959P2Y purinoceptor 14Q9ESG6P2ry14Mus musculus (Mouse)338

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