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Ligand

NameCHEMBL3342367
Molecular formulaC17H16ClN5
IUPAC name4-N-[(4-chlorophenyl)methyl]-2-N-methyl-6-pyridin-2-ylpyrimidine-2,4-diamine
Molecular weight325.8
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.6
SynonymsBDBM50030786
ZINC299836161
Inchi KeyMBSODQQDZFLCRN-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H16ClN5/c1-19-17-22-15(14-4-2-3-9-20-14)10-16(23-17)21-11-12-5-7-13(18)8-6-12/h2-10H,11H2,1H3,(H2,19,21,22,23)
PubChem CID118716410
ChEMBLCHEMBL3342367
IUPHARN/A
BindingDB50030786
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
449624G-protein coupled receptor 39Q5U431Gpr39Mus musculus (Mouse)456
449625G-protein coupled receptor 39O43194GPR39Homo sapiens (Human)453

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