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Ligand

Name[4-[4-[(Z)-C-(4-bromophenyl)-N-hydroxy-carbonimidoyl]-1-piperidyl]-4-methyl-1-piperidyl]-(2,6-dimethylphenyl)methanone
Molecular formulaC27H34BrN3O2
IUPAC name[4-[4-[(Z)-C-(4-bromophenyl)-N-hydroxycarbonimidoyl]piperidin-1-yl]-4-methylpiperidin-1-yl]-(2,6-dimethylphenyl)methanone
Molecular weight512.492
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.7
Synonyms1,4'-Bipiperidine, 4-[(Z)-(4-bromophenyl)(hydroxyimino)methyl]-1'-(2,6-dimethylbenzoyl)-4'-methyl-
Inchi KeyKCYWZQVQSDYWBO-XLVZBRSZSA-N
Inchi IDInChI=1S/C27H34BrN3O2/c1-19-5-4-6-20(2)24(19)26(32)30-17-13-27(3,14-18-30)31-15-11-22(12-16-31)25(29-33)21-7-9-23(28)10-8-21/h4-10,22,33H,11-18H2,1-3H3/b29-25+
PubChem CID9579311
ChEMBLCHEMBL106468
IUPHARN/A
BindingDBN/A
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
166179C-C chemokine receptor type 5P51682Ccr5Mus musculus (Mouse)354

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