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Name | CHEMBL143733 |
---|---|
Molecular formula | C20H23N3O5S |
IUPAC name | 7-[3-[4-(furan-2-carbonyl)piperazin-1-yl]-2-hydroxypropoxy]-4H-1,4-benzothiazin-3-one |
Molecular weight | 417.48 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 1.1 |
Synonyms | 7-[2-Hydroxy-3-[4-(2-furanylcarbonyl)piperazino]propoxy]-3,4-dihydro-2H-1,4-benzothiazine-3-one 7-{3-[4-(Furan-2-carbonyl)-piperazin-1-yl]-2-hydroxy-propoxy}-4H-benzo[1,4]thiazin-3-one BDBM50086672 |
Inchi Key | CJCYZIHADIQBRT-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H23N3O5S/c24-14(12-28-15-3-4-16-18(10-15)29-13-19(25)21-16)11-22-5-7-23(8-6-22)20(26)17-2-1-9-27-17/h1-4,9-10,14,24H,5-8,11-13H2,(H,21,25) |
PubChem CID | 44361790 |
ChEMBL | CHEMBL143733 |
IUPHAR | N/A |
BindingDB | 50086672 |
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 |
---|---|---|---|---|---|
43230 | Beta-1 adrenergic receptor | P18090 | Adrb1 | Rattus norvegicus (Rat) | 466 |
43231 | Beta-2 adrenergic receptor | P54833 | ADRB2 | Canis lupus familiaris (Dog) | 415 |
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