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LUU

Summary
Name:1~{H}-indol-5-ylmethanamine
Formula:C9 H10 N2
Formal charge:0
Formula weight:146.189 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71~{H}-indol-5-ylmethanamine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C9H10N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11H,6,10H2
InChIKeyInChI1.06UAYYSAPJTRVEQA-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NCc1ccc2[nH]ccc2c1
SMILESCACTVS3.385NCc1ccc2[nH]ccc2c1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc2c(cc[nH]2)cc1CN
SMILESOpenEye OEToolkits2.0.7c1cc2c(cc[nH]2)cc1CN

222415

PDB entries from 2024-07-10

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