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BR9

Summary
Name:5-bromopyridine-2,3-diamine
Formula:C5 H6 Br N3
Formal charge:0
Formula weight:188.025 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.65-bromanylpyridine-2,3-diamine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C5H6BrN3/c6-3-1-4(7)5(8)9-2-3/h1-2H,7H2,(H2,8,9)
InChIKeyInChI1.03YRGMYJUKFJPNPD-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1cc(Br)cnc1N
SMILESCACTVS3.385Nc1cc(Br)cnc1N
SMILES_CANONICALOpenEye OEToolkits2.0.6c1c(cnc(c1N)N)Br
SMILESOpenEye OEToolkits2.0.6c1c(cnc(c1N)N)Br

218853

PDB entries from 2024-04-24

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