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Murcko scaffold

Ring system with 4 rings and 22 atoms

4 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
22
Chemicals
4
With full pages
3
Scaffold SMILES

O=C1c2cccc3cccc(c23)C(=O)N1CCN1CCCC1

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=C1c2cccc3cccc(c23)C(=O)N1CCN1CCCC1

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

1H-Benz(de)isoquinoline-1,3(2H)-dione, 6-nitro-2-(2-(1-pyrrolidinyl)ethyl)- chemical structure, C18H17N3O4, CAS 88145-15-7
1H-Benz(de)isoquinoline-1,3(2H)-dione, 6-nitro-2-(2-(1-pyrrolidinyl)ethyl)-
CAS 88145-15-7C18H17N3O4
Pinafide chemical structure, C18H17N3O4, CAS 54824-20-3
Pinafide
CAS 54824-20-3C18H17N3O4
5-Methoxy-2-(2-(1-pyrrolidinyl)ethyl)-1H-benzo(de)isoquinoline-1,3(2H)-dione chemical structure, C19H20N2O3, CAS 69408-99-7
5-Methoxy-2-(2-(1-pyrrolidinyl)ethyl)-1H-benzo(de)isoquinoline-1,3(2H)-dione
CAS 69408-99-7C19H20N2O3
5-Amino-2-(2-(1-pyrrolidinyl)ethyl)-1H-benzo(de)isoquinoline-1,3(2H)-dione chemical structure, C18H19N3O2, CAS 69408-83-9
5-Amino-2-(2-(1-pyrrolidinyl)ethyl)-1H-benzo(de)isoquinoline-1,3(2H)-dione
CAS 69408-83-9C18H19N3O2