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Name | CHEMBL3953289 |
---|---|
Molecular formula | C20H23F3N2O2S |
IUPAC name | 2-[3-[3-cyano-5-(trifluoromethylsulfanyl)phenyl]-3-azaspiro[5.5]undecan-9-yl]acetic acid |
Molecular weight | 412.471 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 5.8 |
Synonyms | SCHEMBL16483019 BDBM50208093 |
Inchi Key | DXIACLRPBPXBLP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H23F3N2O2S/c21-20(22,23)28-17-10-15(13-24)9-16(12-17)25-7-5-19(6-8-25)3-1-14(2-4-19)11-18(26)27/h9-10,12,14H,1-8,11H2,(H,26,27) |
PubChem CID | 73777135 |
ChEMBL | CHEMBL3953289 |
IUPHAR | N/A |
BindingDB | 50208093 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
537733 | Free fatty acid receptor 1 | O14842 | FFAR1 | Homo sapiens (Human) | 300 |
537731 | Free fatty acid receptor 4 | Q7TMA4 | Ffar4 | Mus musculus (Mouse) | 361 |
537732 | Free fatty acid receptor 4 | Q5NUL3 | FFAR4 | Homo sapiens (Human) | 377 |
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