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Name | MLS000521189 |
---|---|
Molecular formula | C21H20FNO4S |
IUPAC name | 5-[(2-fluorophenyl)methylsulfonylmethyl]-N-(2-phenylethyl)furan-2-carboxamide |
Molecular weight | 401.452 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 3.4 |
Synonyms | 5-[(2-fluorophenyl)methylsulfonylmethyl]-N-phenethylfuran-2-carboxamide CHEMBL1700180 ZINC3055515 AC1MSE59 EU-0064996 [ Show all ] |
Inchi Key | CHYXIBROVMUMRJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H20FNO4S/c22-19-9-5-4-8-17(19)14-28(25,26)15-18-10-11-20(27-18)21(24)23-13-12-16-6-2-1-3-7-16/h1-11H,12-15H2,(H,23,24) |
PubChem CID | 3582921 |
ChEMBL | CHEMBL1700180 |
IUPHAR | N/A |
BindingDB | 96610 |
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 |
---|---|---|---|---|---|
42435 | Trace amine-associated receptor 1 | Q96RJ0 | TAAR1 | Homo sapiens (Human) | 339 |
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