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Murcko scaffold

Ring system with 4 rings and 24 atoms

5 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
24
Chemicals
5
With full pages
2
Scaffold SMILES

c1cncc(-c2cc(N3CCOCC3)nc(N3CCOCC3)n2)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 c1cncc(-c2cc(N3CCOCC3)nc(N3CCOCC3)n2)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 5 of 5 chemicals

Buparlisib chemical structure, C18H21F3N6O2, CAS 944396-07-0
Buparlisib
CAS 944396-07-0C18H21F3N6O2
4-Chloro-5-(2,6-di-4-morpholinyl-4-pyrimidinyl)-2-pyridinamine chemical structure, C17H21ClN6O2, CAS 944397-11-9
4-Chloro-5-(2,6-di-4-morpholinyl-4-pyrimidinyl)-2-pyridinamine
CAS 944397-11-9C17H21ClN6O2
Buparlisib hydrochloride chemical structure, C18H22ClF3N6O2, CAS 1312445-63-8
Buparlisib hydrochloride
CAS 1312445-63-8C18H22ClF3N6O2
5-(2,6-Dimorpholinopyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine hydrochloride hydrate chemical structure, C18H24ClF3N6O3, CAS 1389337-64-7
5-(2,6-Dimorpholinopyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-amine hydrochloride hydrate
CAS 1389337-64-7C18H24ClF3N6O3
N-(5-(2,6-Dimorpholinopyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-yl)acetamide chemical structure, C20H23F3N6O3, CAS 1607826-40-3
N-(5-(2,6-Dimorpholinopyrimidin-4-yl)-4-(trifluoromethyl)pyridin-2-yl)acetamide
CAS 1607826-40-3C20H23F3N6O3