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Murcko scaffold

Ring system with 3 rings and 21 atoms

8 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
8
With full pages
6
Scaffold SMILES

c1ccc(Nc2ncnc(CN3CCCCCC3)n2)cc1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffold
Murcko scaffold c1ccc(Nc2ncnc(CN3CCCCCC3)n2)cc1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 8 of 8 chemicals

6-Azepan-1-ylmethyl-N-(4-ethoxy-phenyl)-[1,3,5]triazine-2,4-diamine chemical structure, C18H26N6O, CAS 696610-66-9
6-Azepan-1-ylmethyl-N-(4-ethoxy-phenyl)-[1,3,5]triazine-2,4-diamine
CAS 696610-66-9C18H26N6O
6-(Azepan-1-ylmethyl)-N-(3-chloro-2-methylphenyl)-1,3,5-triazine-2,4-diamine chemical structure, C17H23ClN6, CAS 496771-21-2
6-(Azepan-1-ylmethyl)-N-(3-chloro-2-methylphenyl)-1,3,5-triazine-2,4-diamine
CAS 496771-21-2C17H23ClN6
6-(Azepan-1-ylmethyl)-N-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine chemical structure, C16H21FN6, CAS 573939-57-8
6-(Azepan-1-ylmethyl)-N-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine
CAS 573939-57-8C16H21FN6
6-(Azepan-1-ylmethyl)-N-(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine chemical structure, C17H24N6O, CAS 488745-99-9
6-(Azepan-1-ylmethyl)-N-(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine
CAS 488745-99-9C17H24N6O
6-(Azepan-1-ylmethyl)-N-(2,4-dimethylphenyl)-1,3,5-triazine-2,4-diamine chemical structure, C18H26N6, CAS 573669-94-0
6-(Azepan-1-ylmethyl)-N-(2,4-dimethylphenyl)-1,3,5-triazine-2,4-diamine
CAS 573669-94-0C18H26N6
6-Azepan-1-ylmethyl-N-phenyl-[1,3,5]triazine-2,4-diamine chemical structure, C16H22N6, CAS 670240-40-1
6-Azepan-1-ylmethyl-N-phenyl-[1,3,5]triazine-2,4-diamine
CAS 670240-40-1C16H22N6
6-(Azepan-1-ylmethyl)-N-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine chemical structure, C17H24N6O, CAS 669743-87-7
6-(Azepan-1-ylmethyl)-N-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine
CAS 669743-87-7C17H24N6O
6-(Azepan-1-ylmethyl)-N-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine chemical structure, C17H24N6O, CAS 878440-27-8
6-(Azepan-1-ylmethyl)-N-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine
CAS 878440-27-8C17H24N6O