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CJF

Summary
Name:N4-cyclopropyl-6-morpholin-4-yl-pyrimidine-2,4-diamine
Formula:C11 H17 N5 O
Formal charge:0
Formula weight:235.286 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6~{N}4-cyclopropyl-6-morpholin-4-yl-pyrimidine-2,4-diamine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C11H17N5O/c12-11-14-9(13-8-1-2-8)7-10(15-11)16-3-5-17-6-4-16/h7-8H,1-6H2,(H3,12,13,14,15)
InChIKeyInChI1.03ODSBHVJNQBVQRW-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1nc(NC2CC2)cc(n1)N3CCOCC3
SMILESCACTVS3.385Nc1nc(NC2CC2)cc(n1)N3CCOCC3
SMILES_CANONICALOpenEye OEToolkits2.0.6c1c(nc(nc1N2CCOCC2)N)NC3CC3
SMILESOpenEye OEToolkits2.0.6c1c(nc(nc1N2CCOCC2)N)NC3CC3

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PDB entries from 2024-04-24

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