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

SVI

Summary
Name:(4S)-[1,2,4]triazolo[4,3-a]pyrazine
Formula:C5 H4 N4
Formal charge:0
Formula weight:120.112 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(4S)-[1,2,4]triazolo[4,3-a]pyrazine
OpenEye OEToolkits2.0.7[1,2,4]triazolo[4,3-a]pyrazine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1cncc2nncn12
InChIInChI1.06InChI=1S/C5H4N4/c1-2-9-4-7-8-5(9)3-6-1/h1-4H
InChIKeyInChI1.06NVSPJDGXKBDYIZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385c1cn2cnnc2cn1
SMILESCACTVS3.385c1cn2cnnc2cn1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cn2cnnc2cn1
SMILESOpenEye OEToolkits2.0.7c1cn2cnnc2cn1

222624

数据于2024-07-17公开中

PDB statisticsPDBj update infoContact PDBjnumon