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Murcko scaffold

Ring system with 3 rings and 24 atoms

9 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
24
Chemicals
9
With full pages
1
Scaffold SMILES

O=C1CCc2c(cccc2OCCCNCCc2ccccc2)N1

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=C1CCc2c(cccc2OCCCNCCc2ccccc2)N1

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 9 of 9 chemicals

Bometolol chemical structure, C25H32N2O7, CAS 65008-93-7
Bometolol
CAS 65008-93-7C25H32N2O7
2(1H)-Quinolinone, 3,4-dihydro-5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-8-hydroxy-, monohydrochloride chemical structure, C22H29ClN2O6, CAS 65008-41-5
2(1H)-Quinolinone, 3,4-dihydro-5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-8-hydroxy-, monohydrochloride
CAS 65008-41-5C22H29ClN2O6
2(1H)-Quinolinone, 3,4-dihydro-5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-8-(2-oxopropoxy)-, ethanedioate (salt) chemical structure, C27H34N2O11, CAS 65008-94-8
2(1H)-Quinolinone, 3,4-dihydro-5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-8-(2-oxopropoxy)-, ethanedioate (salt)
CAS 65008-94-8C27H34N2O11
2(1H)-quinolinone, 3,4-dihydro-5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-8-(2-propynyloxy)-, ethanedioate (salt) chemical structure, C27H32N2O10, CAS 65023-15-6
2(1H)-quinolinone, 3,4-dihydro-5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-8-(2-propynyloxy)-, ethanedioate (salt)
CAS 65023-15-6C27H32N2O10
Acetamide, N-(5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-1,2,3,4-tetrahydro-2-oxo-8-quinolinyl)-, monohydrochloride chemical structure, C24H32ClN3O6, CAS 76211-86-4
Acetamide, N-(5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-1,2,3,4-tetrahydro-2-oxo-8-quinolinyl)-, monohydrochloride
CAS 76211-86-4C24H32ClN3O6
Urea, (5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-1,2,3,4-tetrahydro-2-oxo-8-quinolinyl)-, monohydrochloride chemical structure, C23H31ClN4O6, CAS 76412-48-1
Urea, (5-(3-((2-(3,4-dimethoxyphenyl)ethyl)amino)-2-hydroxypropoxy)-1,2,3,4-tetrahydro-2-oxo-8-quinolinyl)-, monohydrochloride
CAS 76412-48-1C23H31ClN4O6
Bometolol hydrochloride chemical structure, C25H33ClN2O7, CAS 65023-16-7
Bometolol hydrochloride
CAS 65023-16-7C25H33ClN2O7
Bometolol, (S)- chemical structure, C25H32N2O7, CAS 79784-50-2
Bometolol, (S)-
CAS 79784-50-2C25H32N2O7
Bometolol, (R)- chemical structure, C25H32N2O7, CAS 79784-52-4
Bometolol, (R)-
CAS 79784-52-4C25H32N2O7