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Murcko scaffold

Ring system with 3 rings and 20 atoms

10 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
20
Chemicals
10
With full pages
1
Scaffold SMILES

c1ccc(C(CN2CCNCC2)C2CCCCC2)cc1

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 c1ccc(C(CN2CCNCC2)C2CCCCC2)cc1

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 10 of 10 chemicals

Hexocyclium chemical structure, C20H33N2O+, CAS 6004-98-4
Hexocyclium
CAS 6004-98-4C20H33N2O+
Tral chemical structure, C21H36N2O5S, CAS 115-63-9
Tral
CAS 115-63-9C21H36N2O5S
Dac 5945 chemical structure, C19H30ClN3O, CAS 124065-13-0
Dac 5945
CAS 124065-13-0C19H30ClN3O
4-(2-Cyclohexyl-2-hydroxy-2-phenylethyl)-1,1-dimethylpiperazin-1-ium methanesulfonate--2-(4-chlorophenyl)-3-methylbutane-2,3-diol (1/1/1) chemical structure, C32H51ClN2O6S, CAS 76485-09-1
4-(2-Cyclohexyl-2-hydroxy-2-phenylethyl)-1,1-dimethylpiperazin-1-ium methanesulfonate--2-(4-chlorophenyl)-3-methylbutane-2,3-diol (1/1/1)
CAS 76485-09-1C32H51ClN2O6S
Cyclohexanol, 1-[1-(3-chlorophenyl)-2-(4-methyl-1-piperazinyl)ethyl]- chemical structure, C19H29ClN2O, CAS 122718-49-4
Cyclohexanol, 1-[1-(3-chlorophenyl)-2-(4-methyl-1-piperazinyl)ethyl]-
CAS 122718-49-4C19H29ClN2O
1-[1-(3-Chlorophenyl)-2-piperazin-1-ylethyl]cyclohexanol chemical structure, C18H27ClN2O, CAS 681803-09-8
1-[1-(3-Chlorophenyl)-2-piperazin-1-ylethyl]cyclohexanol
CAS 681803-09-8C18H27ClN2O
1-[(1S)-2-[(3S,5R)-3,5-Dimethylpiperazin-1-yl]-1-[3-(trifluoromethoxy)phenyl]ethyl]cyclohexan-1-ol chemical structure, C21H31F3N2O2, CAS 850692-43-2
1-[(1S)-2-[(3S,5R)-3,5-Dimethylpiperazin-1-yl]-1-[3-(trifluoromethoxy)phenyl]ethyl]cyclohexan-1-ol
CAS 850692-43-2C21H31F3N2O2
WAY-260022 dihydrochloride chemical structure, C21H33Cl2F3N2O2, CAS 850613-22-8
WAY-260022 dihydrochloride
CAS 850613-22-8C21H33Cl2F3N2O2
(Iso)-WAY-260022 chemical structure, C21H31F3N2O2, CAS 1214914-38-1
(Iso)-WAY-260022
CAS 1214914-38-1C21H31F3N2O2
Hexocyclium iodide chemical structure, C20H33IN2O, CAS 101475-40-5
Hexocyclium iodide
CAS 101475-40-5C20H33IN2O