2,6-bis(N-methylpyridinium-3-ylmethylene)cyclohexanone-Cpd2A
IC50 = 6.2 nM
General
Type : Bisquaternary, Pyridine, Pyridinium
Chemical_Nomenclature : (2E,6E)-2,6-bis[(1-methylpyridin-1-ium-3-yl)methylidene]cyclohexan-1-one\;diiodide
Canonical SMILES : C[N+]1=CC=CC(=C1)\/C=C2\/C(=O)\/C(=C\/C3=C[N+](=CC=C3)C)\/CCC2.[I-].[I-]
InChI : InChI=1S\/C20H22N2O.2HI\/c1-21-10-4-6-16(14-21)12-18-8-3-9-19(20(18)23)13-17-7-5-11-22(2)15-17\;\;\/h4-7,10-15H,3,8-9H2,1-2H3\;2*1H\/q+2\;\;\/p-2\/b18-12+,19-13+
InChIKey : COLFOUVWLDBAAQ-RDGKIGCSSA-L
Other name(s) : 3,3-(1E,1E)-(2-oxocyclohexane-1,3-diylidene)bis(methan-1-yl-1-ylidene)bis(1-methylpyridinium)iodide || Compound 2a || Bb4
cyclohexanone-Cpd2A.gif)
Target
Families : 2,6-bis(N-methylpyridinium-3-ylmethylene)cyclohexanone-Cpd2A ligand of proteins in family
ACHE
Protein :
human-ACHE
References (3)
| Title : Discovery of dual cation-pi inhibitors of acetylcholinesterase: design, synthesis and biological evaluation - Damuka_2020_Pharmacol.Rep__ |
| Author(s) : Damuka N , Kammari K , Potshangbam AM , Rathore RS , Kondapi AK , Vindal V |
| Ref : Pharmacol Rep , : , 2020 |
| Abstract : |
| PubMedSearch : Damuka_2020_Pharmacol.Rep__ |
| PubMedID: 32200493 |
| Title : Discovery of dual cation-pi inhibitors of acetylcholinesterase: design, synthesis and biological evaluation - Damuka_2020_Pharmacol.Rep__ |
| Author(s) : Damuka N , Kammari K , Potshangbam AM , Rathore RS , Kondapi AK , Vindal V |
| Ref : Pharmacol Rep , : , 2020 |
| Abstract : |
| PubMedSearch : Damuka_2020_Pharmacol.Rep__ |
| PubMedID: 32200493 |
| Title : Discovery of dual cation-pi inhibitors of acetylcholinesterase: design, synthesis and biological evaluation - Damuka_2020_Pharmacol.Rep__ |
| Author(s) : Damuka N , Kammari K , Potshangbam AM , Rathore RS , Kondapi AK , Vindal V |
| Ref : Pharmacol Rep , : , 2020 |
| Abstract : |
| PubMedSearch : Damuka_2020_Pharmacol.Rep__ |
| PubMedID: 32200493 |