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Name | CHEMBL221664 |
---|---|
Molecular formula | C26H31FN2O3 |
IUPAC name | 2-[2-[4-(1-butyl-6-fluoroindol-3-yl)piperidin-1-yl]ethoxy]benzoic acid |
Molecular weight | 438.543 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 2.8 |
Synonyms | BDBM50156879 2-{2-[4-(1-butyl-6-fluoro-1H-indol-3-yl)piperidin-1-yl]-ethoxy}benzoic acid |
Inchi Key | ZMOAWDWBPDLQAJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H31FN2O3/c1-2-3-12-29-18-23(21-9-8-20(27)17-24(21)29)19-10-13-28(14-11-19)15-16-32-25-7-5-4-6-22(25)26(30)31/h4-9,17-19H,2-3,10-16H2,1H3,(H,30,31) |
PubChem CID | 11189839 |
ChEMBL | CHEMBL221664 |
IUPHAR | N/A |
BindingDB | 50156879 |
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 |
---|---|---|---|---|---|
432240 | Histamine H1 receptor | P70174 | Hrh1 | Mus musculus (Mouse) | 488 |
432241 | Histamine H1 receptor | P31389 | HRH1 | Cavia porcellus (Guinea pig) | 488 |
432239 | Histamine H2 receptor | P25021 | HRH2 | Homo sapiens (Human) | 359 |
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