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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL3342368
Molecular formulaC16H16N6
IUPAC name2-N-methyl-6-pyridin-2-yl-4-N-(pyridin-4-ylmethyl)pyrimidine-2,4-diamine
Molecular weight292.346
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP1.9
SynonymsBDBM50030785
Inchi KeyPZFFKFAUQFEDHR-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H16N6/c1-17-16-21-14(13-4-2-3-7-19-13)10-15(22-16)20-11-12-5-8-18-9-6-12/h2-10H,11H2,1H3,(H2,17,20,21,22)
PubChem CID118716411
ChEMBLCHEMBL3342368
IUPHARN/A
BindingDB50030785
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
452469G-protein coupled receptor 39Q5U431Gpr39Mus musculus (Mouse)456
452470G-protein coupled receptor 39O43194GPR39Homo sapiens (Human)453

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