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507

Summary
Name:1-{3-[6-(tetrahydro-2H-pyran-4-ylamino)imidazo[1,2-b]pyridazin-3-yl]phenyl}ethanone
Formula:C19 H20 N4 O2
Formal charge:0
Formula weight:336.388 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.011-{3-[6-(tetrahydro-2H-pyran-4-ylamino)imidazo[1,2-b]pyridazin-3-yl]phenyl}ethanone
OpenEye OEToolkits1.7.01-[3-[6-(oxan-4-ylamino)imidazo[2,1-f]pyridazin-3-yl]phenyl]ethanone

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(c1cccc(c1)c2cnc3ccc(nn23)NC4CCOCC4)C
SMILES_CANONICALCACTVS3.370CC(=O)c1cccc(c1)c2cnc3ccc(NC4CCOCC4)nn23
SMILESCACTVS3.370CC(=O)c1cccc(c1)c2cnc3ccc(NC4CCOCC4)nn23
SMILES_CANONICALOpenEye OEToolkits1.7.0CC(=O)c1cccc(c1)c2cnc3n2nc(cc3)NC4CCOCC4
SMILESOpenEye OEToolkits1.7.0CC(=O)c1cccc(c1)c2cnc3n2nc(cc3)NC4CCOCC4
InChIInChI1.03InChI=1S/C19H20N4O2/c1-13(24)14-3-2-4-15(11-14)17-12-20-19-6-5-18(22-23(17)19)21-16-7-9-25-10-8-16/h2-6,11-12,16H,7-10H2,1H3,(H,21,22)
InChIKeyInChI1.03DTUZIVBPPQTBFT-UHFFFAOYSA-N

223532

PDB entries from 2024-08-07

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