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Name | CHEMBL423473 |
---|---|
Molecular formula | C15H17IN2O2 |
IUPAC name | 3-(1H-imidazol-5-yl)propyl 3-(4-iodophenyl)propanoate |
Molecular weight | 384.217 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 3.1 |
Synonyms | ZINC13747354 3-(4-Iodo-phenyl)-propionic acid 3-(1H-imidazol-4-yl)-propyl ester BDBM50050168 SCHEMBL8104619 4-Iodobenzenepropionic acid 3-(1H-imidazol-4-yl)propyl ester |
Inchi Key | ASQUEGTXNJDXRT-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C15H17IN2O2/c16-13-6-3-12(4-7-13)5-8-15(19)20-9-1-2-14-10-17-11-18-14/h3-4,6-7,10-11H,1-2,5,8-9H2,(H,17,18) |
PubChem CID | 10620015 |
ChEMBL | CHEMBL423473 |
IUPHAR | N/A |
BindingDB | 50050168 |
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 |
---|---|---|---|---|---|
13441 | Histamine H1 receptor | P31389 | HRH1 | Cavia porcellus (Guinea pig) | 488 |
13440 | Histamine H2 receptor | P47747 | HRH2 | Cavia porcellus (Guinea pig) | 359 |
13439 | Histamine H3 receptor | Q9QYN8 | Hrh3 | Rattus norvegicus (Rat) | 445 |
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