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Name | SCHEMBL3034532 |
---|---|
Molecular formula | C18H16F3NO2 |
IUPAC name | 1-[[4-[3-(trifluoromethyl)phenyl]phenyl]methyl]azetidine-3-carboxylic acid |
Molecular weight | 335.326 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 1.3 |
Synonyms | CHEMBL3742100 |
Inchi Key | DWVHOLDUKGHWIL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H16F3NO2/c19-18(20,21)16-3-1-2-14(8-16)13-6-4-12(5-7-13)9-22-10-15(11-22)17(23)24/h1-8,15H,9-11H2,(H,23,24) |
PubChem CID | 59451824 |
ChEMBL | CHEMBL3742100 |
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 |
---|---|---|---|---|---|
523616 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
523615 | Sphingosine 1-phosphate receptor 5 | Q9H228 | S1PR5 | Homo sapiens (Human) | 398 |
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