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A1H4L

Summary
Name:1H-pyrrolo[3,2-b]pyridin-5-amine
Synonyms:HYDROXYETHYLAMINE BACE INHIBITOR
Formula:C7 H7 N3
Formal charge:0
Formula weight:133.151 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71~{H}-pyrrolo[3,2-b]pyridin-5-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C7H7N3/c8-7-2-1-5-6(10-7)3-4-9-5/h1-4,9H,(H2,8,10)
InChIKeyInChI1.06NOEYQOAKBMZXFX-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1ccc2[nH]ccc2n1
SMILESCACTVS3.385Nc1ccc2[nH]ccc2n1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(nc2c1[nH]cc2)N
SMILESOpenEye OEToolkits2.0.7c1cc(nc2c1[nH]cc2)N

224004

PDB entries from 2024-08-21

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