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Name | 332358-89-1 |
---|---|
Molecular formula | C21H23NO4S |
IUPAC name | 2-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)methylsulfanyl]benzoic acid |
Molecular weight | 385.478 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 3.9 |
Synonyms | SMR000272708 2-(6,7-Dimethoxy-3,3-dimethyl-3,4-dihydro-isoquinolin-1-yl-methylsulfanyl)benzoic acid AKOS000300934 HMS2633M24 MLS000706542 [ Show all ] |
Inchi Key | ACPLMNUIXAQIPP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H23NO4S/c1-21(2)11-13-9-17(25-3)18(26-4)10-15(13)16(22-21)12-27-19-8-6-5-7-14(19)20(23)24/h5-10H,11-12H2,1-4H3,(H,23,24) |
PubChem CID | 1121308 |
ChEMBL | CHEMBL1538778 |
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 |
---|---|---|---|---|---|
1764 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
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