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Name | CHEMBL20191 |
---|---|
Molecular formula | C13H13IN2O2 |
IUPAC name | 3-(1H-imidazol-5-yl)propyl 2-iodobenzoate |
Molecular weight | 356.163 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 3.3 |
Synonyms | 2-Iodo-benzoic acid 3-(1H-imidazol-4-yl)-propyl ester BDBM50050182 |
Inchi Key | AVYKVIPNQOLGOF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C13H13IN2O2/c14-12-6-2-1-5-11(12)13(17)18-7-3-4-10-8-15-9-16-10/h1-2,5-6,8-9H,3-4,7H2,(H,15,16) |
PubChem CID | 10618217 |
ChEMBL | CHEMBL20191 |
IUPHAR | N/A |
BindingDB | 50050182 |
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 |
---|---|---|---|---|---|
15764 | Histamine H1 receptor | P31389 | HRH1 | Cavia porcellus (Guinea pig) | 488 |
15763 | Histamine H2 receptor | P47747 | HRH2 | Cavia porcellus (Guinea pig) | 359 |
15762 | Histamine H3 receptor | Q9QYN8 | Hrh3 | Rattus norvegicus (Rat) | 445 |
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