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Name | CHEMBL222356 |
---|---|
Molecular formula | C27H27FN2O4 |
IUPAC name | 5-[[4-[6-fluoro-1-(furan-3-ylmethyl)indol-3-yl]piperidin-1-yl]methyl]-2-methoxybenzoic acid |
Molecular weight | 462.521 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 2.1 |
Synonyms | SCHEMBL5348129 5-[4-(6-fluoro-1-furan-3-ylmethyl-1H-indol-3-yl)piperidin-1-ylmethyl]-2-methoxybenzoic acid BDBM50156877 |
Inchi Key | PLADVISFXRAPMA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H27FN2O4/c1-33-26-5-2-18(12-23(26)27(31)32)14-29-9-6-20(7-10-29)24-16-30(15-19-8-11-34-17-19)25-13-21(28)3-4-22(24)25/h2-5,8,11-13,16-17,20H,6-7,9-10,14-15H2,1H3,(H,31,32) |
PubChem CID | 10139591 |
ChEMBL | CHEMBL222356 |
IUPHAR | N/A |
BindingDB | 50156877 |
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 |
---|---|---|---|---|---|
262396 | Histamine H1 receptor | P70174 | Hrh1 | Mus musculus (Mouse) | 488 |
262398 | Histamine H1 receptor | P31389 | HRH1 | Cavia porcellus (Guinea pig) | 488 |
262397 | Histamine H2 receptor | P25021 | HRH2 | Homo sapiens (Human) | 359 |
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