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Name | CHEMBL15909 |
---|---|
Molecular formula | C29H36FN5O2 |
IUPAC name | 1-[2-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]ethyl]-3-(1'-methylspiro[2H-1-benzofuran-3,4'-piperidine]-5-yl)urea |
Molecular weight | 505.638 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 3.8 |
Synonyms | 1-[1'-Methylspiro[benzofuran-3(2H),4'-piperidine]-5-yl]-3-[2-[4-(6-fluoro-1H-indole-3-yl)piperidino]ethyl]urea BDBM50086117 1-{2-[4-(6-fluoro-1H-indol-3-yl)piperidin-1yl]ethyl}-[2,3-Dihydro-1''-methylspiro(benzofuran-3,4''-piperidine)]-amide |
Inchi Key | HCDXKCGDMXPSKS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H36FN5O2/c1-34-13-8-29(9-14-34)19-37-27-5-3-22(17-25(27)29)33-28(36)31-10-15-35-11-6-20(7-12-35)24-18-32-26-16-21(30)2-4-23(24)26/h2-5,16-18,20,32H,6-15,19H2,1H3,(H2,31,33,36) |
PubChem CID | 10625376 |
ChEMBL | CHEMBL15909 |
IUPHAR | N/A |
BindingDB | 50086117 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
111189 | 5-hydroxytryptamine receptor 1A | P19327 | Htr1a | Rattus norvegicus (Rat) | 422 |
111188 | 5-hydroxytryptamine receptor 1B | P28564 | Htr1b | Rattus norvegicus (Rat) | 386 |
111190 | 5-hydroxytryptamine receptor 1D | P28565 | Htr1d | Rattus norvegicus (Rat) | 374 |
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