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Ligand

NameSCHEMBL14660667
Molecular formulaC29H40N6O
IUPAC name2-(2,6-dimethylphenyl)-4-[(2R,4R)-4-methoxy-2-methylpiperidin-1-yl]-6-(2-methyl-5-propan-2-ylpyrazol-3-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
Molecular weight488.68
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP5.4
SynonymsBDBM134526
US8846656, 23-C
Inchi KeyCKBAYCPZJJQREU-FGZHOGPDSA-N
Inchi IDInChI=1S/C29H40N6O/c1-18(2)25-16-26(33(6)32-25)34-13-12-24-23(17-34)29(35-14-11-22(36-7)15-21(35)5)31-28(30-24)27-19(3)9-8-10-20(27)4/h8-10,16,18,21-22H,11-15,17H2,1-7H3/t21-,22-/m1/s1
PubChem CID71239070
ChEMBLN/A
IUPHARN/A
BindingDB134526
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
558631C5a anaphylatoxin chemotactic receptor 1P21730C5AR1Homo sapiens (Human)350

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