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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Sphingosine 1-phosphate receptor 2
Species	Rattus norvegicus (Rat)
Gene	S1pr2
Synonym	S1P2 receptor S1P2 S1P receptor Edg-5 S1P receptor 2 GPCR18 Gpcr13 G-protein coupled receptor H218 G protein-coupled receptor 13 Endothelial differentiation G-protein coupled receptor 5 endothelial differentiation G protein-coupled receptor 5 edg5 AGR16 Sphingosine 1-phosphate receptor Edg-5 [ Show all ]
Disease	N/A for non-human GPCRs
Length	352
Amino acid sequence	MGGLYSEYLNPEKVQEHYNYTKETLDMQETPSRKVASAFIIILCCAIVVENLLVLIAVARNSKFHSAMYLFLGNLAASDLLAGVAFVANTLLSGPVTLSLTPLQWFAREGSAFITLSASVFSLLAIAIERQVAIAKVKLYGSDKSCRMLMLIGASWLISLILGGLPILGWNCLDHLEACSTVLPLYAKHYVLCVVTIFSVILLAIVALYVRIYFVVRSSHADVAGPQTLALLKTVTIVLGVFIICWLPAFSILLLDSTCPVRACPVLYKAHYFFAFATLNSLLNPVIYTWRSRDLRREVLRPLLCWRQGKGATGRRGGNPGHRLLPLRSSSSLERGLHMPTSPTFLEGNTVV
UniProt	P47752
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3616360
IUPHAR	276
DrugBank	N/A

Ligand

Name	CHEMBL3618189
Molecular formula	C19H26F4N2O2
IUPAC name	4-(2-ethylbutyl)-N-[3-fluoro-5-(trifluoromethyl)phenyl]-4-hydroxypiperidine-1-carboxamide
Molecular weight	390.423
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	4.6
Synonyms	BDBM50120513 SCHEMBL5912113
Inchi Key	GINKVFDHXDQKPU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H26F4N2O2/c1-3-13(4-2)12-18(27)5-7-25(8-6-18)17(26)24-16-10-14(19(21,22)23)9-15(20)11-16/h9-11,13,27H,3-8,12H2,1-2H3,(H,24,26)
PubChem CID	23071977
ChEMBL	CHEMBL3618189
IUPHAR	N/A
BindingDB	50120513
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	72.0 nM	PMID26384288	BindingDB,ChEMBL

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