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Ligand

NameCHEMBL2032437
Molecular formulaC29H27F3N2O3
IUPAC name1-[3-[2-[4-phenyl-3-(trifluoromethyl)phenyl]-1,3-benzoxazol-5-yl]propyl]piperidine-4-carboxylic acid
Molecular weight508.541
Hydrogen bond acceptor8
Hydrogen bond donor1
XlogP4.3
SynonymsBDBM50420035
Inchi KeyALKIJLGJRSRYHL-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H27F3N2O3/c30-29(31,32)24-18-22(9-10-23(24)20-6-2-1-3-7-20)27-33-25-17-19(8-11-26(25)37-27)5-4-14-34-15-12-21(13-16-34)28(35)36/h1-3,6-11,17-18,21H,4-5,12-16H2,(H,35,36)
PubChem CID70685939
ChEMBLCHEMBL2032437
IUPHARN/A
BindingDB50420035
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
8341Sphingosine 1-phosphate receptor 1P21453S1PR1Homo sapiens (Human)382
8342Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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