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Name | CHEMBL44261 |
---|---|
Molecular formula | C16H21IN2O2 |
IUPAC name | 1-(dicyclopropylmethylideneamino)oxy-3-(4-iodoanilino)propan-2-ol |
Molecular weight | 400.26 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 3.2 |
Synonyms | BDBM50064212 Dicyclopropyl ketone O-[2-hydroxy-3-[(4-iodophenyl)amino]propyl]oxime Dicyclopropyl-methanone O-[2-hydroxy-3-(4-iodo-phenylamino)-propyl]-oxime |
Inchi Key | HYMRIWGOEMUUFN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H21IN2O2/c17-13-5-7-14(8-6-13)18-9-15(20)10-21-19-16(11-1-2-11)12-3-4-12/h5-8,11-12,15,18,20H,1-4,9-10H2 |
PubChem CID | 10553898 |
ChEMBL | CHEMBL44261 |
IUPHAR | N/A |
BindingDB | 50064212 |
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 |
---|---|---|---|---|---|
127180 | Beta-2 adrenergic receptor | P54833 | ADRB2 | Canis lupus familiaris (Dog) | 415 |
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