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Murcko scaffold

Ring system with 3 rings and 18 atoms

7 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
7
With full pages
1
Scaffold SMILES

c1cc(-c2ccncn2)nc(-c2ccncn2)c1

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 c1cc(-c2ccncn2)nc(-c2ccncn2)c1

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 7 of 7 chemicals

4,4'-(Pyridine-2,6-diyl)bis(6-ethoxy-2-methylpyrimidine) chemical structure, C19H21N5O2, CAS 87568-87-4
4,4'-(Pyridine-2,6-diyl)bis(6-ethoxy-2-methylpyrimidine)
CAS 87568-87-4C19H21N5O2
4,4'-(Pyridine-2,6-diyl)bis[6-ethoxy-2-(methylsulfanyl)pyrimidine] chemical structure, C19H21N5O2S2, CAS 87568-90-9
4,4'-(Pyridine-2,6-diyl)bis[6-ethoxy-2-(methylsulfanyl)pyrimidine]
CAS 87568-90-9C19H21N5O2S2
4-[6-(2-Aminopyrimidin-4-yl)-3-methoxypyridin-2-yl]pyrimidin-2-amine chemical structure, C14H13N7O, CAS 1983984-49-1
4-[6-(2-Aminopyrimidin-4-yl)-3-methoxypyridin-2-yl]pyrimidin-2-amine
CAS 1983984-49-1C14H13N7O
Avotaciclib chemical structure, C13H11N7O, CAS 1983983-41-0
Avotaciclib
CAS 1983983-41-0C13H11N7O
Avotaciclib sulfate chemical structure, C13H13N7O5S, CAS 1983984-04-8
Avotaciclib sulfate
CAS 1983984-04-8C13H13N7O5S
Avotaciclib trihydrochloride chemical structure, C13H14Cl3N7O, CAS 1983984-01-5
Avotaciclib trihydrochloride
CAS 1983984-01-5C13H14Cl3N7O
Avotaciclib dihydrochloride chemical structure, C13H13Cl2N7O, CAS 2451957-59-6
Avotaciclib dihydrochloride
CAS 2451957-59-6C13H13Cl2N7O