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Ligand

NameCHEMBL244610
Molecular formulaC25H33N3O
IUPAC name1-[1-[[(1E)-cycloocten-1-yl]methyl]piperidin-4-yl]-3-naphthalen-2-ylurea
Molecular weight391.559
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP5.4
Synonyms(E)-1-(1-(cyclooctenylmethyl)piperidin-4-yl)-3-(naphthalen-2-yl)urea
1-(1-(cyclooctenylmethyl)piperidin-4-yl)-3-(naphthalen-2-yl)urea
BDBM50198394
Inchi KeyMZMYJUORJONGQJ-DNTJNYDQSA-N
Inchi IDInChI=1S/C25H33N3O/c29-25(27-24-13-12-21-10-6-7-11-22(21)18-24)26-23-14-16-28(17-15-23)19-20-8-4-2-1-3-5-9-20/h6-8,10-13,18,23H,1-5,9,14-17,19H2,(H2,26,27,29)/b20-8+
PubChem CID9886775
ChEMBLCHEMBL244610
IUPHARN/A
BindingDB50198394
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
217978C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368
217979C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367

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