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Name | CHEMBL286686 |
---|---|
Molecular formula | C33H58N4O4+2 |
IUPAC name | 3-[(3aS,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]propyl-[7-[3-[(3aS,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]propyl-dimethylazaniumyl]heptyl]-dimethylazanium |
Molecular weight | 574.851 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 0 |
XlogP | 4.1 |
Synonyms | N,N'-(1,7-Heptanediyl)bis[[3-[[(3aR)-3abeta,4,5,6,7,7abeta-hexahydro-1,3-dioxoisoindolin]-2-yl]propyl]dimethylaminium] |
Inchi Key | DNWIGZVZEVCVLT-FXCIUYFGSA-N |
Inchi ID | InChI=1S/C33H58N4O4/c1-36(2,24-14-20-34-30(38)26-16-8-9-17-27(26)31(34)39)22-12-6-5-7-13-23-37(3,4)25-15-21-35-32(40)28-18-10-11-19-29(28)33(35)41/h26-29H,5-25H2,1-4H3/q+2/t26-,27+,28-,29+ |
PubChem CID | 44279471 |
ChEMBL | CHEMBL286686 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
64718 | Muscarinic acetylcholine receptor M2 | P06199 | CHRM2 | Sus scrofa (Pig) | 466 |
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