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Name | CHEMBL1807874 |
---|---|
Molecular formula | C23H31N3O4S |
IUPAC name | 4-hydroxy-7-[(1R)-1-hydroxy-2-[3-[2-[methyl(2-phenylethyl)amino]ethoxy]propylamino]ethyl]-3H-1,3-benzothiazol-2-one |
Molecular weight | 445.578 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 4 |
XlogP | 2.2 |
Synonyms | BDBM50418947 |
Inchi Key | AJVZNDDUZGAVJT-FQEVSTJZSA-N |
Inchi ID | InChI=1S/C23H31N3O4S/c1-26(12-10-17-6-3-2-4-7-17)13-15-30-14-5-11-24-16-20(28)18-8-9-19(27)21-22(18)31-23(29)25-21/h2-4,6-9,20,24,27-28H,5,10-16H2,1H3,(H,25,29)/t20-/m0/s1 |
PubChem CID | 56670092 |
ChEMBL | CHEMBL1807874 |
IUPHAR | N/A |
BindingDB | 50418947 |
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 |
---|---|---|---|---|---|
7284 | Beta-1 adrenergic receptor | P08588 | ADRB1 | Homo sapiens (Human) | 477 |
7285 | Beta-2 adrenergic receptor | P07550 | ADRB2 | Homo sapiens (Human) | 413 |
7283 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
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