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

JNE

Summary
Name:6-methyl-~{N}-(phenylmethyl)pyridin-2-amine
Formula:C13 H14 N2
Formal charge:0
Formula weight:198.264 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.76-methyl-~{N}-(phenylmethyl)pyridin-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C13H14N2/c1-11-6-5-9-13(15-11)14-10-12-7-3-2-4-8-12/h2-9H,10H2,1H3,(H,14,15)
InChIKeyInChI1.03FJZQUYGOKRVORO-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cc1cccc(NCc2ccccc2)n1
SMILESCACTVS3.385Cc1cccc(NCc2ccccc2)n1
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1cccc(n1)NCc2ccccc2
SMILESOpenEye OEToolkits2.0.7Cc1cccc(n1)NCc2ccccc2

218853

PDB entries from 2024-04-24

PDB statisticsPDBj update infoContact PDBjnumon