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07U

Summary
Name:2-methyl-N~1~-[3-(pyridin-4-yl)-2,6-naphthyridin-1-yl]propane-1,2-diamine
Formula:C17 H19 N5
Formal charge:0
Formula weight:293.366 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-methyl-N~1~-[3-(pyridin-4-yl)-2,6-naphthyridin-1-yl]propane-1,2-diamine
OpenEye OEToolkits1.7.22-methyl-N1-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01n2cc1cc(nc(c1cc2)NCC(N)(C)C)c3ccncc3
InChIInChI1.03InChI=1S/C17H19N5/c1-17(2,18)11-21-16-14-5-8-20-10-13(14)9-15(22-16)12-3-6-19-7-4-12/h3-10H,11,18H2,1-2H3,(H,21,22)
InChIKeyInChI1.03WNDOFCPEDZYDPL-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370CC(C)(N)CNc1nc(cc2cnccc12)c3ccncc3
SMILESCACTVS3.370CC(C)(N)CNc1nc(cc2cnccc12)c3ccncc3
SMILES_CANONICALOpenEye OEToolkits1.7.2CC(C)(CNc1c2ccncc2cc(n1)c3ccncc3)N
SMILESOpenEye OEToolkits1.7.2CC(C)(CNc1c2ccncc2cc(n1)c3ccncc3)N

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PDB entries from 2024-03-27

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