IC50 hBCHE Lys(Boc) (5e) 0.14 +/- 0.05 microM
Type : Fluoren, Carbamate, Trimethylammonium
Chemical_Nomenclature : tert-Butyl N-[(5S)-5-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-{[2-(trimethylazaniumyl)ethyl]carbamoyl}pentyl]carbamate iodide
Canonical SMILES : C1(COC(N[C@H](C(NCC[N+](C)(C)C)=O)CCCCNC(OC(C)(C)C)=O)=O)C3=C(C2=C1C=CC=C2)C=CC=C3.[I-]
InChI : InChI=1S\/C31H44N4O5.HI\/c1-31(2,3)40-29(37)33-18-12-11-17-27(28(36)32-19-20-35(4,5)6)34-30(38)39-21-26-24-15-9-7-13-22(24)23-14-8-10-16-25(23)26\;\/h7-10,13-16,26-27H,11-12,17-21H2,1-6H3,(H2-,32,33,34,36,37,38)\;1H\/t27-\;\/m0.\/s1
InChIKey : GJCMOZYBUXHHIC-YCBFMBTMSA-N
Other name(s) : Fmoc-Lys(Boc)-trimethylammonium amide analog (5e) || Compound 5e
Families : Fmoc-Lys(Boc)-trimethylammonium-5e ligand of proteins in family
BCHE
Protein :
human-BCHE
Title : Synthesis and Evaluation of Fmoc-Amino Esters and Amides Bearing a Substrate Like Quaternary Ammonium Group as Selective Butyrylcholinesterase Inhibitors - Godinez_2023_Bioorg.Med.Chem.Lett__129392 |
Author(s) : Godinez J , Lee CY , Schwans JP |
Ref : Bioorganic & Medicinal Chemistry Lett , :129392 , 2023 |
Abstract : |
PubMedSearch : Godinez_2023_Bioorg.Med.Chem.Lett__129392 |
PubMedID: 37364726 |