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Murcko scaffold

Ring system with 5 rings and 28 atoms

4 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
28
Chemicals
4
With full pages
1
Scaffold SMILES

O=C1NC(=Nc2ccc(N=C3NC(=O)c4ccccc43)cc2)c2ccccc21

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=C1NC(=Nc2ccc(N=C3NC(=O)c4ccccc43)cc2)c2ccccc21

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-Isoindol-1-one, 3,3'-[(2-chloro-1,4-phenylene)dinitrilo]bis[2,3-dihydro- chemical structure, C22H13ClN4O2, CAS 60009-98-5
1H-Isoindol-1-one, 3,3'-[(2-chloro-1,4-phenylene)dinitrilo]bis[2,3-dihydro-
CAS 60009-98-5C22H13ClN4O2
Pigment Yellow 110 chemical structure, C22H6Cl8N4O2, CAS 5590-18-1
Pigment Yellow 110
CAS 5590-18-1C22H6Cl8N4O2
1H-Isoindol-1-one, 3,3'-((2,5-dichloro-1,4-phenylene)diimino)bis- chemical structure, C22H12Cl2N4O2, CAS 51016-63-8
1H-Isoindol-1-one, 3,3'-((2,5-dichloro-1,4-phenylene)diimino)bis-
CAS 51016-63-8C22H12Cl2N4O2
1H-Isoindol-1-one, 3,3'-((2-chloro-1,4-phenylene)dinitrilo)bis(4,5,6,7-tetrachloro-2,3-dihydro- chemical structure, C22H5Cl9N4O2, CAS 65883-03-6
1H-Isoindol-1-one, 3,3'-((2-chloro-1,4-phenylene)dinitrilo)bis(4,5,6,7-tetrachloro-2,3-dihydro-
CAS 65883-03-6C22H5Cl9N4O2