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Murcko scaffold

Ring system with 4 rings and 29 atoms

6 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
29
Chemicals
6
With full pages
1
Scaffold SMILES

O=C(C1CCCCC1)C(CCN1CCN(c2ccccc2)CC1)c1ccccc1

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(C1CCCCC1)C(CCN1CCN(c2ccccc2)CC1)c1ccccc1

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-Cyclohexyl-4-(4-(2-methoxyphenyl)piperazin-1-yl)-2-methyl-2-phenylbutan-1-one chemical structure, C28H38N2O2, CAS 228418-79-9
1-Cyclohexyl-4-(4-(2-methoxyphenyl)piperazin-1-yl)-2-methyl-2-phenylbutan-1-one
CAS 228418-79-9C28H38N2O2
LY-426965 chemical structure, C28H38N2O2, CAS 228418-82-4
LY-426965
CAS 228418-82-4C28H38N2O2
LY-426965 hydrochloride chemical structure, C28H39ClN2O2, CAS 326821-27-6
LY-426965 hydrochloride
CAS 326821-27-6C28H39ClN2O2
1-Cyclohexyl-4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-2-phenyl-butan-1-one dihydrochloride chemical structure, C28H40Cl2N2O2, CAS 228418-81-3
1-Cyclohexyl-4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-2-phenyl-butan-1-one dihydrochloride
CAS 228418-81-3C28H40Cl2N2O2
(2R)-1-Cyclohexyl-4-[4-(2-methoxyphenyl)-1-piperazinyl]-2-methyl-2-phenyl-1-butanone chemical structure, C28H38N2O2, CAS 228418-83-5
(2R)-1-Cyclohexyl-4-[4-(2-methoxyphenyl)-1-piperazinyl]-2-methyl-2-phenyl-1-butanone
CAS 228418-83-5C28H38N2O2
(R)-(-)-LY 426965 dihydrochloride chemical structure, C28H40Cl2N2O2, CAS 228418-85-7
(R)-(-)-LY 426965 dihydrochloride
CAS 228418-85-7C28H40Cl2N2O2