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Ligand

NameCHEMBL397647
Molecular formulaC21H25Cl2N2O2+
IUPAC name[4-[(3,4-dichlorobenzoyl)amino]phenyl]methyl-dimethyl-(oxan-4-yl)azanium
Molecular weight408.343
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP4.7
SynonymsBDBM50216435
N-(4-(3,4-dichlorobenzamido)benzyl)-N,N-dimethyl-tetrahydro-2H-pyran-4-aminium
SCHEMBL2739842
Inchi KeyBXCVNDLGUWFNBK-UHFFFAOYSA-O
Inchi IDInChI=1S/C21H24Cl2N2O2/c1-25(2,18-9-11-27-12-10-18)14-15-3-6-17(7-4-15)24-21(26)16-5-8-19(22)20(23)13-16/h3-8,13,18H,9-12,14H2,1-2H3/p+1
PubChem CID11502371
ChEMBLCHEMBL397647
IUPHARN/A
BindingDB50216435
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34973C-C chemokine receptor type 2P41597CCR2Homo sapiens (Human)374
34975C-C chemokine receptor type 2P51683Ccr2Mus musculus (Mouse)373
34974C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352

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