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Name | CHEMBL3086532 |
---|---|
Molecular formula | C13H16ClFN4O3S |
IUPAC name | 3-chloro-N-[(1R)-1-(4-ethyl-5-methoxy-1,2,4-triazol-3-yl)ethyl]-4-fluorobenzenesulfonamide |
Molecular weight | 362.804 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 1.7 |
Synonyms | SCHEMBL12248881 TASP-0251078 |
Inchi Key | CZEKSFTXHJDYSF-MRVPVSSYSA-N |
Inchi ID | InChI=1S/C13H16ClFN4O3S/c1-4-19-12(16-17-13(19)22-3)8(2)18-23(20,21)9-5-6-11(15)10(14)7-9/h5-8,18H,4H2,1-3H3/t8-/m1/s1 |
PubChem CID | 57699087 |
ChEMBL | CHEMBL3086532 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
54204 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
54206 | Sphingosine 1-phosphate receptor 3 | Q99500 | S1PR3 | Homo sapiens (Human) | 378 |
54205 | Sphingosine 1-phosphate receptor 4 | O95977 | S1PR4 | Homo sapiens (Human) | 384 |
54207 | Sphingosine 1-phosphate receptor 5 | Q9H228 | S1PR5 | Homo sapiens (Human) | 398 |
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