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Murcko scaffold

Ring system with 4 rings and 28 atoms

4 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
28
Chemicals
4
With full pages
2
Scaffold SMILES

O=C(COc1ccc(-c2nc3[nH]c(=O)[nH]c(=O)c3[nH]2)cc1)Nc1ccccc1

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 O=C(COc1ccc(-c2nc3[nH]c(=O)[nH]c(=O)c3[nH]2)cc1)Nc1ccccc1

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 4 of 4 chemicals

Mrs-1706 chemical structure, C27H29N5O5, CAS 264622-53-9
Mrs-1706
CAS 264622-53-9C27H29N5O5
Mrs-1754 chemical structure, C26H26N6O4, CAS 264622-58-4
Mrs-1754
CAS 264622-58-4C26H26N6O4
Methyl 4-{2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetamido}benzoate chemical structure, C27H29N5O6, CAS 264622-54-0
Methyl 4-{2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]acetamido}benzoate
CAS 264622-54-0C27H29N5O6
2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]-N-(4-nitrophenyl)acetamide chemical structure, C25H26N6O6, CAS 264622-59-5
2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy]-N-(4-nitrophenyl)acetamide
CAS 264622-59-5C25H26N6O6