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PRA

Summary
Name:3-PHENYLPROPYLAMINE
Formula:C9 H13 N
Formal charge:0
Formula weight:135.206 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.013-phenylpropan-1-amine
OpenEye OEToolkits2.0.73-phenylpropan-1-amine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(CCc1ccccc1)N
InChIInChI1.03InChI=1S/C9H13N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,10H2
InChIKeyInChI1.03LYUQWQRTDLVQGA-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NCCCc1ccccc1
SMILESCACTVS3.385NCCCc1ccccc1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)CCCN
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)CCCN

218853

PDB entries from 2024-04-24

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