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Ligand

NameCHEMBL3618198
Molecular formulaC29H25F2N3O4
IUPAC nameN-[3-(4-fluorophenoxy)-5-pyridin-4-yloxyphenyl]-4-(4-fluorophenyl)-4-hydroxypiperidine-1-carboxamide
Molecular weight517.533
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.5
SynonymsBDBM50120581
Inchi KeyJNQJEJOYNMPQBZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H25F2N3O4/c30-21-3-1-20(2-4-21)29(36)11-15-34(16-12-29)28(35)33-23-17-26(37-24-7-5-22(31)6-8-24)19-27(18-23)38-25-9-13-32-14-10-25/h1-10,13-14,17-19,36H,11-12,15-16H2,(H,33,35)
PubChem CID122190864
ChEMBLCHEMBL3618198
IUPHARN/A
BindingDB50120581
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
482121Sphingosine 1-phosphate receptor 2P47752S1pr2Rattus norvegicus (Rat)352
482122Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353

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