Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

KWU

Summary
Name:N-methyl-1-(quinoxalin-6-yl)methanamine
Formula:C10 H11 N3
Formal charge:0
Formula weight:173.214 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-methyl-1-(quinoxalin-6-yl)methanamine
OpenEye OEToolkits2.0.7~{N}-methyl-1-quinoxalin-6-yl-methanamine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01CNCc1cc2nccnc2cc1
InChIInChI1.03InChI=1S/C10H11N3/c1-11-7-8-2-3-9-10(6-8)13-5-4-12-9/h2-6,11H,7H2,1H3
InChIKeyInChI1.03QRZKMXOFPHWLCH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CNCc1ccc2nccnc2c1
SMILESCACTVS3.385CNCc1ccc2nccnc2c1
SMILES_CANONICALOpenEye OEToolkits2.0.7CNCc1ccc2c(c1)nccn2
SMILESOpenEye OEToolkits2.0.7CNCc1ccc2c(c1)nccn2

222415

PDB entries from 2024-07-10

PDB statisticsPDBj update infoContact PDBjnumon