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Substrate Report for: CHEMBL1784957

Name Class
CHEMBL1784957TypeDrug
Pro-drug
Carbamate
Derivative of Rivastigmine
Other_Name (5)
Chemical_Nomenclature[3-[(1S)-1-(dimethylamino)ethyl]phenyl] N-[(2S)-1-phenylpropan-2-yl]carbamate
FormulaC20H26N2O2
MW326.4
PaperVerheijen_2009_Bioorg.Med.Chem.Lett_19_3243
CommentCarbamate cholinesterase inhibitor. Conjugation of the phenol derived from rivastigmine with d-amphetamine
CID25205011
InChIKeyHKJROXHSAHRDAO-HOTGVXAUSA-N
CanonicalSMILESCC(CC1=CC=CC=C1)NC(=O)OC2=CC=CC(=C2)C(C)N(C)C
InChIInChI=1S/C20H26N2O2/c1-15(13-17-9-6-5-7-10-17)21-20(23)24-19-12-8-11-18(14-19)16(2)22(3)4/h5-12,14-16H,13H2,1-4H3,(H,21,23)/t15-,16-/m0/s1

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Please cite: Lenfant 2013 Nucleic.Acids.Res. or Marchot Chatonnet 2012 Prot.Pept Lett.
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