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RKQ

Summary
Name:4-[2-methyl-3-(2-phenoxyethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
Formula:C20 H20 N6 O
Formal charge:0
Formula weight:360.412 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.74-[2-methyl-3-(2-phenoxyethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C20H20N6O/c1-13-23-17-8-7-16(14-11-18(21)25-19(22)12-14)24-20(17)26(13)9-10-27-15-5-3-2-4-6-15/h2-8,11-12H,9-10H2,1H3,(H4,21,22,25)
InChIKeyInChI1.03XQMMPFLQOCIGRW-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cc1nc2ccc(nc2n1CCOc3ccccc3)c4cc(N)nc(N)c4
SMILESCACTVS3.385Cc1nc2ccc(nc2n1CCOc3ccccc3)c4cc(N)nc(N)c4
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1nc2ccc(nc2n1CCOc3ccccc3)c4cc(nc(c4)N)N
SMILESOpenEye OEToolkits2.0.7Cc1nc2ccc(nc2n1CCOc3ccccc3)c4cc(nc(c4)N)N

223532

PDB entries from 2024-08-07

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