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Ligand

NameCHEMBL198277
Molecular formulaC31H37ClN2O3S
IUPAC nameN-[1-[3-(4-chlorophenyl)-3-phenylpropyl]piperidin-4-yl]-N-ethyl-2-(4-methylsulfonylphenyl)acetamide
Molecular weight553.158
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP5.9
SynonymsBDBM50173378
N-{1-[3-(4-Chloro-phenyl)-3-phenyl-propyl]-piperidin-4-yl}-N-ethyl-2-(4-methanesulfonyl-phenyl)-acetamide
Inchi KeyASZPWIAQUZJALQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H37ClN2O3S/c1-3-34(31(35)23-24-9-15-29(16-10-24)38(2,36)37)28-17-20-33(21-18-28)22-19-30(25-7-5-4-6-8-25)26-11-13-27(32)14-12-26/h4-16,28,30H,3,17-23H2,1-2H3
PubChem CID44404596
ChEMBLCHEMBL198277
IUPHARN/A
BindingDB50173378
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
13752C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352

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