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Name | CHEMBL447626 |
---|---|
Molecular formula | C23H26INO3 |
IUPAC name | (2-butyl-1-benzofuran-3-yl)-[4-[2-(ethylamino)ethoxy]-3-iodophenyl]methanone |
Molecular weight | 491.369 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 6.1 |
Synonyms | BDBM50247119 (2-butylbenzofuran-3-yl)(4-(2-(ethylamino)ethoxy)-3-iodophenyl)methanone |
Inchi Key | CFVCYTDXVQNGLP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H26INO3/c1-3-5-9-21-22(17-8-6-7-10-19(17)28-21)23(26)16-11-12-20(18(24)15-16)27-14-13-25-4-2/h6-8,10-12,15,25H,3-5,9,13-14H2,1-2H3 |
PubChem CID | 13455777 |
ChEMBL | CHEMBL447626 |
IUPHAR | N/A |
BindingDB | 50247119 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
41016 | Trace amine-associated receptor 1 | Q96RJ0 | TAAR1 | Homo sapiens (Human) | 339 |
41017 | Trace amine-associated receptor 1 | Q923Y9 | Taar1 | Rattus norvegicus (Rat) | 332 |
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