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Name | 5-HT4 antagonist 1 |
---|---|
Molecular formula | C23H36N4O5S |
IUPAC name | N-[[1-[3-(4-methylpiperazin-1-yl)sulfonylpropyl]piperidin-4-yl]methyl]-2,3-dihydro-1,4-benzodioxine-5-carboxamide |
Molecular weight | 480.624 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 1.2 |
Synonyms | 261766-73-8 L019596 BDBM50162859 CS-0018166 SCHEMBL7952197 [ Show all ] |
Inchi Key | AUXZCLHKLUWDDZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H36N4O5S/c1-25-11-13-27(14-12-25)33(29,30)17-3-8-26-9-6-19(7-10-26)18-24-23(28)20-4-2-5-21-22(20)32-16-15-31-21/h2,4-5,19H,3,6-18H2,1H3,(H,24,28) |
PubChem CID | 9869791 |
ChEMBL | CHEMBL180632 |
IUPHAR | N/A |
BindingDB | 50162859 |
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 |
---|---|---|---|---|---|
15052 | 5-hydroxytryptamine receptor 4 | Q13639 | HTR4 | Homo sapiens (Human) | 388 |
15054 | 5-hydroxytryptamine receptor 4 | Q62758 | Htr4 | Rattus norvegicus (Rat) | 406 |
15053 | Histamine H1 receptor | P31390 | Hrh1 | Rattus norvegicus (Rat) | 486 |
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