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1LN

Summary
Name:2-(2-aminopyridin-1-ium-1-yl)ethanol
Formula:C7 H11 N2 O
Formal charge:1
Formula weight:139.175 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits1.7.62-(2-azanylpyridin-1-yl)ethanol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C7H11N2O/c8-7-3-1-2-4-9(7)5-6-10/h1-4,10H,5-6,8H2
InChIKeyInChI1.03BFRGFNNQJWMZSX-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370Nc1ccccn1CCO
SMILESCACTVS3.370Nc1ccccn1CCO
SMILES_CANONICALOpenEye OEToolkits1.7.6C1=CC=[N](C(=C1)N)CCO
SMILESOpenEye OEToolkits1.7.6C1=CC=[N](C(=C1)N)CCO

223532

PDB entries from 2024-08-07

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