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Name | CHEMBL3230445 |
---|---|
Molecular formula | C25H33ClN2O8 |
IUPAC name | N-[3-chloro-4-[2-hydroxy-3-[2-(4-hydroxyphenyl)ethylamino]propoxy]phenyl]hexanamide;oxalic acid |
Molecular weight | 524.995 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 6 |
XlogP | None |
Synonyms | N/A |
Inchi Key | HXJMRLMVNRBKJS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H31ClN2O4.C2H2O4/c1-2-3-4-5-23(29)26-18-8-11-22(21(24)14-18)30-16-20(28)15-25-13-12-17-6-9-19(27)10-7-17;3-1(4)2(5)6/h6-11,14,20,25,27-28H,2-5,12-13,15-16H2,1H3,(H,26,29);(H,3,4)(H,5,6) |
PubChem CID | 12541336 |
ChEMBL | CHEMBL3230445 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
126285 | Beta-1 adrenergic receptor | P18090 | Adrb1 | Rattus norvegicus (Rat) | 466 |
126284 | Beta-2 adrenergic receptor | P10608 | Adrb2 | Rattus norvegicus (Rat) | 418 |
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