CHEMBL4454960-PET

General

Type : PET probe,Carbamate

Chemical_Nomenclature :

Canonical SMILES : C1(=CC=C2C(=C1)CN3C(N2C)C4=C(CC3)C=CC=C4)OC(=O)NCCCCCCN5CCOC(C5)CF

InChI : InChI=1S\/C29H39FN4O3\/c1-32-27-11-10-24(18-23(27)20-34-15-12-22-8-4-5-9-26(22)28(32)34)37-29(35)31-13-6-2-3-7-14-33-16-17-36-25(19-30)21-33\/h4-5,8-11,18,25,28H,2-3,6-7,12-17,19-21H2,1H3,(H,31,35)

InChIKey : CUQLIAQPLJMYMW-UHFFFAOYSA-N

Other name(s) :

MW : 510.65

Formula : C29H39FN4O3

CAS_number :

PubChem :

UniChem : CUQLIAQPLJMYMW-UHFFFAOYSA-N

IUPHAR :

Wikipedia :

Target

Families : CHEMBL4454960-PET ligand of proteins in family: BCHE

Stucture :

Protein : human-BCHE

References (1)

Title : Synthesis and Initial Characterization of a Selective, Pseudo-irreversible Inhibitor of Human Butyrylcholinesterase as PET Tracer - Gentzsch_2021_ChemMedChem__

Author(s) : Gentzsch C , Hoffmann M , Ohshima Y , Nose N , Chen X , Higuchi T , Decker M

Ref : ChemMedChem , : , 2021

Abstract : Gentzsch_2021_ChemMedChem__

ESTHER : Gentzsch_2021_ChemMedChem__

PubMedSearch : Gentzsch_2021_ChemMedChem__

PubMedID: 33645891

CHEMBL4454960-PET

General

Target

References (1)

1. Synthesis and Initial Characterization of a Selective, Pseudo-irreversible Inhibitor of Human Butyrylcholinesterase as PET Tracer