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Ligand

NameCHEMBL488690
Molecular formulaC27H37ClN6O2
IUPAC nameN-(4-chlorophenyl)-2-[4-[2-(diethylamino)ethyl]-1,4-diazepan-1-yl]-6,7-dimethoxyquinazolin-4-amine
Molecular weight513.083
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP5.4
SynonymsBDBM50245112
N-(4-Chlorophenyl)-2-{4-[2-(diethylamino)ethyl]-1,4-diazepan-1-yl}-6,7-dimethoxyquinazolin-4-amine
Inchi KeyABSJDAAPHZEZFF-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H37ClN6O2/c1-5-32(6-2)14-15-33-12-7-13-34(17-16-33)27-30-23-19-25(36-4)24(35-3)18-22(23)26(31-27)29-21-10-8-20(28)9-11-21/h8-11,18-19H,5-7,12-17H2,1-4H3,(H,29,30,31)
PubChem CID44562236
ChEMBLCHEMBL488690
IUPHARN/A
BindingDB50245112
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
1131C-C chemokine receptor type 4P51679CCR4Homo sapiens (Human)360
1132C-C chemokine receptor type 4P51680Ccr4Mus musculus (Mouse)360

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