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Name | CHEMBL16496 |
---|---|
Molecular formula | C14H16IN3O2 |
IUPAC name | 3-(1H-imidazol-5-yl)propyl N-[(4-iodophenyl)methyl]carbamate |
Molecular weight | 385.205 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 2.6 |
Synonyms | (4-Iodo-benzyl)-carbamic acid 3-(1H-imidazol-4-yl)-propyl ester BDBM50050183 4-Iodobenzylcarbamic acid 3-(1H-imidazol-4-yl)propyl ester |
Inchi Key | BUCKBBFABVVKHW-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H16IN3O2/c15-12-5-3-11(4-6-12)8-17-14(19)20-7-1-2-13-9-16-10-18-13/h3-6,9-10H,1-2,7-8H2,(H,16,18)(H,17,19) |
PubChem CID | 10833949 |
ChEMBL | CHEMBL16496 |
IUPHAR | N/A |
BindingDB | 50050183 |
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 |
---|---|---|---|---|---|
32905 | Histamine H1 receptor | P31389 | HRH1 | Cavia porcellus (Guinea pig) | 488 |
32904 | Histamine H2 receptor | P47747 | HRH2 | Cavia porcellus (Guinea pig) | 359 |
32906 | Histamine H3 receptor | Q9QYN8 | Hrh3 | Rattus norvegicus (Rat) | 445 |
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