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Ligand

NameCHEMBL3618196
Molecular formulaC31H27ClFN3O5
IUPAC nameN-[3-(4-carbamoylphenoxy)-5-(4-fluorophenoxy)phenyl]-4-(4-chlorophenyl)-4-hydroxypiperidine-1-carboxamide
Molecular weight576.021
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP4.9
SynonymsBDBM50120579
SCHEMBL15911131
Inchi KeyFMWIFZSAKGQXPC-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H27ClFN3O5/c32-22-5-3-21(4-6-22)31(39)13-15-36(16-14-31)30(38)35-24-17-27(40-25-9-1-20(2-10-25)29(34)37)19-28(18-24)41-26-11-7-23(33)8-12-26/h1-12,17-19,39H,13-16H2,(H2,34,37)(H,35,38)
PubChem CID90309206
ChEMBLCHEMBL3618196
IUPHARN/A
BindingDB50120579
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
473046Sphingosine 1-phosphate receptor 2O95136S1PR2Homo sapiens (Human)353
473047Sphingosine 1-phosphate receptor 2P47752S1pr2Rattus norvegicus (Rat)352

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