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Name | CHEMBL279617 |
---|---|
Molecular formula | C13H14N4O4 |
IUPAC name | 3-(1H-imidazol-5-yl)propyl N-(3-nitrophenyl)carbamate |
Molecular weight | 290.279 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 1.8 |
Synonyms | (3-Nitro-phenyl)-carbamic acid 3-(1H-imidazol-4-yl)-propyl ester BDBM50051215 SCHEMBL7961200 3-Nitrophenylcarbamic acid 3-(1H-imidazol-4-yl)propyl ester |
Inchi Key | IXZVARDZBBMVPA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C13H14N4O4/c18-13(21-6-2-4-11-8-14-9-15-11)16-10-3-1-5-12(7-10)17(19)20/h1,3,5,7-9H,2,4,6H2,(H,14,15)(H,16,18) |
PubChem CID | 10732219 |
ChEMBL | CHEMBL279617 |
IUPHAR | N/A |
BindingDB | 50051215 |
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 |
---|---|---|---|---|---|
144459 | Histamine H1 receptor | P31389 | HRH1 | Cavia porcellus (Guinea pig) | 488 |
144458 | Histamine H2 receptor | P47747 | HRH2 | Cavia porcellus (Guinea pig) | 359 |
144456 | Histamine H3 receptor | Q9QYN8 | Hrh3 | Rattus norvegicus (Rat) | 445 |
144457 | Histamine H3 receptor | P58406 | Hrh3 | Mus musculus (Mouse) | 445 |
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