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Ligand

NameCHEMBL426960
Molecular formulaC31H35N3O3
IUPAC nameN-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(4-nitrophenyl)-N-prop-2-enylacetamide
Molecular weight497.639
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP6.1
SynonymsBDBM50157019
N-Allyl-N-[1-(3,3-diphenyl-propyl)-piperidin-4-yl]-2-(4-nitro-phenyl)-acetamide
Inchi KeyAKEHDJQAUFRJKQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H35N3O3/c1-2-20-33(31(35)24-25-13-15-29(16-14-25)34(36)37)28-17-21-32(22-18-28)23-19-30(26-9-5-3-6-10-26)27-11-7-4-8-12-27/h2-16,28,30H,1,17-24H2
PubChem CID44392094
ChEMBLCHEMBL426960
IUPHARN/A
BindingDB50157019
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
7470C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352

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