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Name | CHEMBL277989 |
---|---|
Molecular formula | C13H14BrN3O2 |
IUPAC name | 3-(1H-imidazol-5-yl)propyl N-(4-bromophenyl)carbamate |
Molecular weight | 324.178 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 3.1 |
Synonyms | BDBM50051198 N-(4-Bromophenyl)carbamic acid 3-(1H-imidazol-4-yl)propyl ester (4-Bromo-phenyl)-carbamic acid 3-(1H-imidazol-4-yl)-propyl ester |
Inchi Key | GJZMTFLOQMQOGJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C13H14BrN3O2/c14-10-3-5-11(6-4-10)17-13(18)19-7-1-2-12-8-15-9-16-12/h3-6,8-9H,1-2,7H2,(H,15,16)(H,17,18) |
PubChem CID | 10711079 |
ChEMBL | CHEMBL277989 |
IUPHAR | N/A |
BindingDB | 50051198 |
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 |
---|---|---|---|---|---|
98410 | Histamine H1 receptor | P31389 | HRH1 | Cavia porcellus (Guinea pig) | 488 |
98413 | Histamine H2 receptor | P47747 | HRH2 | Cavia porcellus (Guinea pig) | 359 |
98411 | Histamine H3 receptor | Q9QYN8 | Hrh3 | Rattus norvegicus (Rat) | 445 |
98412 | Histamine H3 receptor | P58406 | Hrh3 | Mus musculus (Mouse) | 445 |
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