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Murcko scaffold

Ring system with 5 rings and 30 atoms

6 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
30
Chemicals
6
With full pages
1
Scaffold SMILES

O=C1c2ccccc2C(=O)c2c(NC3CCCCC3)ccc(Nc3ccccc3)c21

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=C1c2ccccc2C(=O)c2c(NC3CCCCC3)ccc(Nc3ccccc3)c21

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 6 of 6 chemicals

1-((4-Ethoxyphenyl)amino)-4-((3,3,5-trimethylcyclohexyl)amino)anthraquinone chemical structure, C31H34N2O3, CAS 29205-96-7
1-((4-Ethoxyphenyl)amino)-4-((3,3,5-trimethylcyclohexyl)amino)anthraquinone
CAS 29205-96-7C31H34N2O3
1-(Cyclohexylamino)-4-((4-ethoxyphenyl)amino)anthraquinone chemical structure, C28H28N2O3, CAS 77946-99-7
1-(Cyclohexylamino)-4-((4-ethoxyphenyl)amino)anthraquinone
CAS 77946-99-7C28H28N2O3
1-((4-Hydroxyphenyl)amino)-4-((3,3,5-trimethylcyclohexyl)amino)anthraquinone chemical structure, C29H30N2O3, CAS 79817-57-5
1-((4-Hydroxyphenyl)amino)-4-((3,3,5-trimethylcyclohexyl)amino)anthraquinone
CAS 79817-57-5C29H30N2O3
Sodium 5-((9,10-dihydro-9,10-dioxo-4-((3,3,5-trimethylcyclohexyl)amino)-1-anthryl)amino)-2-hydroxybenzenesulphonate chemical structure, C29H29N2NaO6S, CAS 79135-78-7
Sodium 5-((9,10-dihydro-9,10-dioxo-4-((3,3,5-trimethylcyclohexyl)amino)-1-anthryl)amino)-2-hydroxybenzenesulphonate
CAS 79135-78-7C29H29N2NaO6S
Sodium 5-((9,10-dihydro-9,10-dioxo-4-((3,3,5-trimethylcyclohexyl)amino)-1-anthryl)amino)-2-ethoxybenzenesulphonate chemical structure, C31H33N2NaO6S, CAS 79135-79-8
Sodium 5-((9,10-dihydro-9,10-dioxo-4-((3,3,5-trimethylcyclohexyl)amino)-1-anthryl)amino)-2-ethoxybenzenesulphonate
CAS 79135-79-8C31H33N2NaO6S
Benzenesulfonic acid, 2-[[4-(cyclohexylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]amino]-5-ethoxy-, sodium salt (1:1) chemical structure, C28H27N2NaO6S, CAS 68214-62-0
Benzenesulfonic acid, 2-[[4-(cyclohexylamino)-9,10-dihydro-9,10-dioxo-1-anthracenyl]amino]-5-ethoxy-, sodium salt (1:1)
CAS 68214-62-0C28H27N2NaO6S