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Ligand

NameCHEMBL34053
Molecular formulaC26H32N2O2
IUPAC nameN-[1-(cyclohexylmethyl)piperidin-4-yl]-9H-xanthene-9-carboxamide
Molecular weight404.554
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP4.9
Synonyms9H-Xanthene-9-carboxylic acid (1-cyclohexylmethyl-piperidin-4-yl)-amide
BDBM50098629
SCHEMBL8184988
Inchi KeyQDBACOKTSIEAAJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H32N2O2/c29-26(27-20-14-16-28(17-15-20)18-19-8-2-1-3-9-19)25-21-10-4-6-12-23(21)30-24-13-7-5-11-22(24)25/h4-7,10-13,19-20,25H,1-3,8-9,14-18H2,(H,27,29)
PubChem CID10525291
ChEMBLCHEMBL34053
IUPHARN/A
BindingDB50098629
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
275334C-C chemokine receptor type 1P51675Ccr1Mus musculus (Mouse)355
275335C-C chemokine receptor type 1P32246CCR1Homo sapiens (Human)355

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