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D8H

Summary
Name:6-(2-(5-(3-methoxypropylamino)pyridin-3-yl)ethyl)-4-methylpyridin-2-amine
Formula:C17 H24 N4 O
Formal charge:0
Formula weight:300.399 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits1.7.66-[2-[5-(3-methoxypropylamino)pyridin-3-yl]ethyl]-4-methyl-pyridin-2-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C17H24N4O/c1-13-8-15(21-17(18)9-13)5-4-14-10-16(12-19-11-14)20-6-3-7-22-2/h8-12,20H,3-7H2,1-2H3,(H2,18,21)
InChIKeyInChI1.03DFYOVMPZILDHIP-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COCCCNc1cncc(CCc2cc(C)cc(N)n2)c1
SMILESCACTVS3.385COCCCNc1cncc(CCc2cc(C)cc(N)n2)c1
SMILES_CANONICALOpenEye OEToolkits1.7.6Cc1cc(nc(c1)N)CCc2cc(cnc2)NCCCOC
SMILESOpenEye OEToolkits1.7.6Cc1cc(nc(c1)N)CCc2cc(cnc2)NCCCOC

248942

PDB entries from 2026-02-11

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