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Ligand

NameCHEMBL399045
Molecular formulaC26H29Cl3N2O
IUPAC name(E)-1-[4-[[4-(4-chlorophenyl)piperidin-1-yl]methyl]piperidin-1-yl]-3-(3,4-dichlorophenyl)prop-2-en-1-one
Molecular weight491.881
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP6.7
SynonymsBDBM50222227
SCHEMBL18840986
(E)-1-(4-((4-(4-chlorophenyl)piperidin-1-yl)methyl)piperidin-1-yl)-3-(3,4-dichlorophenyl)prop-2-en-1-one
Inchi KeyAKKGFQRBBVGLEB-KRXBUXKQSA-N
Inchi IDInChI=1S/C26H29Cl3N2O/c27-23-5-3-21(4-6-23)22-11-13-30(14-12-22)18-20-9-15-31(16-10-20)26(32)8-2-19-1-7-24(28)25(29)17-19/h1-8,17,20,22H,9-16,18H2/b8-2+
PubChem CID25033361
ChEMBLCHEMBL399045
IUPHARN/A
BindingDB50222227
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
442010C-C chemokine receptor type 1P32246CCR1Homo sapiens (Human)355
7624C-C chemokine receptor type 2P41597CCR2Homo sapiens (Human)374
7623C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355

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