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Ligand

NameCHEMBL51480
Molecular formulaC26H34FN3O2
IUPAC name2-[[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methyl]-N-(3-methoxyphenyl)piperidine-1-carboxamide
Molecular weight439.575
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.8
Synonyms2-[4-(4-Fluoro-benzyl)-piperidin-1-ylmethyl]-piperidine-1-carboxylic acid (3-methoxy-phenyl)-amide
BDBM50115018
Inchi KeyBSZULKCGCBLLIO-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H34FN3O2/c1-32-25-7-4-5-23(18-25)28-26(31)30-14-3-2-6-24(30)19-29-15-12-21(13-16-29)17-20-8-10-22(27)11-9-20/h4-5,7-11,18,21,24H,2-3,6,12-17,19H2,1H3,(H,28,31)
PubChem CID44295480
ChEMBLCHEMBL51480
IUPHARN/A
BindingDB50115018
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
32160C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355

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