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Ligand

NameCHEMBL2180528
Molecular formulaC23H27ClN2O2
IUPAC nameN-[(2R)-1-[4-(4-chlorophenyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]benzamide
Molecular weight398.931
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP5.0
SynonymsBDBM50399208
SCHEMBL2159606
(R)-N-(1-(4-(4-Chlorophenyl)piperidin-1-yl)-3-methyl-1-oxobutan-2-yl)benzamide
TYQNFWIJWOXJPV-OAQYLSRUSA-N
Inchi KeyTYQNFWIJWOXJPV-OAQYLSRUSA-N
Inchi IDInChI=1S/C23H27ClN2O2/c1-16(2)21(25-22(27)19-6-4-3-5-7-19)23(28)26-14-12-18(13-15-26)17-8-10-20(24)11-9-17/h3-11,16,18,21H,12-15H2,1-2H3,(H,25,27)/t21-/m1/s1
PubChem CID24758044
ChEMBLCHEMBL2180528
IUPHARN/A
BindingDB50399208
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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
330690C-C chemokine receptor type 1P32246CCR1Homo sapiens (Human)355
330692C-C chemokine receptor type 1P51675Ccr1Mus musculus (Mouse)355
330689C-C chemokine receptor type 2P41597CCR2Homo sapiens (Human)374
330693C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355
330691C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352

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