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Name | CHEMBL230489 |
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Molecular formula | C28H31F3N2O5 |
IUPAC name | 2-[3-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]propyl]phenyl]-N-[[4-(trifluoromethoxy)phenyl]methyl]acetamide |
Molecular weight | 532.56 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 5 |
XlogP | 4.2 |
Synonyms | SCHEMBL4261050 |
Inchi Key | BYOZRDSUPAUFPE-DWXRJYCRSA-N |
Inchi ID | InChI=1S/C28H31F3N2O5/c1-18(32-16-26(36)22-7-10-25(35)23(14-22)17-34)11-20-3-2-4-21(12-20)13-27(37)33-15-19-5-8-24(9-6-19)38-28(29,30)31/h2-10,12,14,18,26,32,34-36H,11,13,15-17H2,1H3,(H,33,37)/t18-,26+/m1/s1 |
PubChem CID | 11237917 |
ChEMBL | CHEMBL230489 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
35960 | Beta-2 adrenergic receptor | Q8K4Z4 | Adrb2 | Cavia porcellus (Guinea pig) | 418 |
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