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XGY

Summary
Name:(4S)-1-methylimidazolidin-4-amine
Formula:C4 H11 N3
Formal charge:0
Formula weight:101.15 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(4S)-1-methylimidazolidin-4-amine
OpenEye OEToolkits2.0.7(4~{S})-1-methylimidazolidin-4-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01CN1CC(NC1)N
InChIInChI1.03InChI=1S/C4H11N3/c1-7-2-4(5)6-3-7/h4,6H,2-3,5H2,1H3/t4-/m0/s1
InChIKeyInChI1.03VFALPSXHULBHMC-BYPYZUCNSA-N
SMILES_CANONICALCACTVS3.385CN1CN[C@H](N)C1
SMILESCACTVS3.385CN1CN[CH](N)C1
SMILES_CANONICALOpenEye OEToolkits2.0.7CN1C[C@H](NC1)N
SMILESOpenEye OEToolkits2.0.7CN1CC(NC1)N

226262

PDB entries from 2024-10-16

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