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Ligand

NameCHEMBL496152
Molecular formulaC27H34ClN5O3
IUPAC nameN-(4-chlorophenyl)-6,7-dimethoxy-2-[4-(3-methoxypiperidin-1-yl)piperidin-1-yl]quinazolin-4-amine
Molecular weight512.051
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP5.4
SynonymsBDBM50265668
N-(4-chlorophenyl)-6,7-dimethoxy-2-(3-methoxy-1,4''-bipiperidin-1''-yl)quinazolin-4-amine
Inchi KeyWOMWTCFFKLQKJG-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H34ClN5O3/c1-34-21-5-4-12-33(17-21)20-10-13-32(14-11-20)27-30-23-16-25(36-3)24(35-2)15-22(23)26(31-27)29-19-8-6-18(28)7-9-19/h6-9,15-16,20-21H,4-5,10-14,17H2,1-3H3,(H,29,30,31)
PubChem CID44581043
ChEMBLCHEMBL496152
IUPHARN/A
BindingDB50265668
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
378463C-C chemokine receptor type 4P51680Ccr4Mus musculus (Mouse)360
378464C-C chemokine receptor type 4P51679CCR4Homo sapiens (Human)360

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