Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help

W30

Summary
Name:6-(2-(5-((2-methoxyethyl)(methyl)amino)pyridin-3-yl)ethyl)-4-methylpyridin-2-amine
Formula:C17 H24 N4 O
Formal charge:0
Formula weight:300.399 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits1.7.66-[2-[5-[2-methoxyethyl(methyl)amino]pyridin-3-yl]ethyl]-4-methyl-pyridin-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C17H24N4O/c1-13-8-15(20-17(18)9-13)5-4-14-10-16(12-19-11-14)21(2)6-7-22-3/h8-12H,4-7H2,1-3H3,(H2,18,20)
InChIKeyInChI1.03PDIACSYIIWCGFI-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COCCN(C)c1cncc(CCc2cc(C)cc(N)n2)c1
SMILESCACTVS3.385COCCN(C)c1cncc(CCc2cc(C)cc(N)n2)c1
SMILES_CANONICALOpenEye OEToolkits1.7.6Cc1cc(nc(c1)N)CCc2cc(cnc2)N(C)CCOC
SMILESOpenEye OEToolkits1.7.6Cc1cc(nc(c1)N)CCc2cc(cnc2)N(C)CCOC

248636

PDB entries from 2026-02-04

PDB statisticsPDBj update infoContact PDBjnumon