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A1AKA

Summary
Name:(8S)-3-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
Formula:C7 H11 N3
Formal charge:0
Formula weight:137.182 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(8S)-3-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
OpenEye OEToolkits2.0.73-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Cc1cnn2CCNCc12
InChIInChI1.06InChI=1S/C7H11N3/c1-6-4-9-10-3-2-8-5-7(6)10/h4,8H,2-3,5H2,1H3
InChIKeyInChI1.06GHWWEPXDSAHILS-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cc1cnn2CCNCc12
SMILESCACTVS3.385Cc1cnn2CCNCc12
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1cnn2c1CNCC2
SMILESOpenEye OEToolkits2.0.7Cc1cnn2c1CNCC2

220472

PDB entries from 2024-05-29

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