You can:
Name | Sphingosine 1-phosphate receptor 4 |
---|---|
Species | Homo sapiens (Human) |
Gene | S1PR4 |
Synonym | S1P4 receptor S1P4 S1P receptor Edg-6 S1P receptor 4 endothelial differentiation, G protein-coupled receptor 6 [ Show all ] |
Disease | N/A |
Length | 384 |
Amino acid sequence | MNATGTPVAPESCQQLAAGGHSRLIVLHYNHSGRLAGRGGPEDGGLGALRGLSVAASCLVVLENLLVLAAITSHMRSRRWVYYCLVNITLSDLLTGAAYLANVLLSGARTFRLAPAQWFLREGLLFTALAASTFSLLFTAGERFATMVRPVAESGATKTSRVYGFIGLCWLLAALLGMLPLLGWNCLCAFDRCSSLLPLYSKRYILFCLVIFAGVLATIMGLYGAIFRLVQASGQKAPRPAARRKARRLLKTVLMILLAFLVCWGPLFGLLLADVFGSNLWAQEYLRGMDWILALAVLNSAVNPIIYSFRSREVCRAVLSFLCCGCLRLGMRGPGDCLARAVEAHSGASTTDSSLRPRDSFRGSRSLSFRMREPLSSISSVRSI |
UniProt | O95977 |
Protein Data Bank | N/A |
GPCR-HGmod model | O95977 |
3D structure model | This predicted structure model is from GPCR-EXP O95977. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL3230 |
IUPHAR | 278 |
DrugBank | N/A |
Name | MLS000073782 |
---|---|
Molecular formula | C17H16F3N5O3S3 |
IUPAC name | N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylpropanamide |
Molecular weight | 491.522 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 1 |
XlogP | 2.8 |
Synonyms | CHEMBL1410897 N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-propanamide AC1LCSJ6 MLS-0041503.0001 SMR000006025 [ Show all ] |
Inchi Key | CKELAGJMAWSHKC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H16F3N5O3S3/c1-9(2)14-24-25-15(30-14)23-13(26)5-7-31(27,28)16-21-10(11-4-3-6-29-11)8-12(22-16)17(18,19)20/h3-4,6,8-9H,5,7H2,1-2H3,(H,23,25,26) |
PubChem CID | 655335 |
ChEMBL | CHEMBL1410897 |
IUPHAR | N/A |
BindingDB | 70287 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 1104.0 nM | PubChem BioAssay data set | ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218