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Murcko scaffold

Ring system with 3 rings and 17 atoms

6 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
6
With full pages
0
Scaffold SMILES

c1ccc(C2OCC(C3CCCCN3)O2)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(C2OCC(C3CCCCN3)O2)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 6 of 6 chemicals

2-(2-Methyl-2-phenyl-1,3-dioxolan-4-yl)piperidine--hydrogen chloride (1/1) chemical structure, C15H22ClNO2, CAS 4913-06-8
2-(2-Methyl-2-phenyl-1,3-dioxolan-4-yl)piperidine--hydrogen chloride (1/1)
CAS 4913-06-8C15H22ClNO2
2-(2-Phenyl-1,3-dioxolan-4-yl)piperidine--hydrogen chloride (1/1) chemical structure, C14H20ClNO2, CAS 7456-94-2
2-(2-Phenyl-1,3-dioxolan-4-yl)piperidine--hydrogen chloride (1/1)
CAS 7456-94-2C14H20ClNO2
2-(2-Ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidine--hydrogen chloride (1/1) chemical structure, C16H24ClNO2, CAS 3666-68-0
2-(2-Ethyl-2-phenyl-1,3-dioxolan-4-yl)piperidine--hydrogen chloride (1/1)
CAS 3666-68-0C16H24ClNO2
Etoxadrol chemical structure, C16H23NO2, CAS 28189-85-7
Etoxadrol
CAS 28189-85-7C16H23NO2
Etoxadrol hydrochloride chemical structure, C16H24ClNO2, CAS 23239-37-4
Etoxadrol hydrochloride
CAS 23239-37-4C16H24ClNO2
Etoxadrol-2-isothiocyanate chemical structure, C17H22N2O2S, CAS 117994-64-6
Etoxadrol-2-isothiocyanate
CAS 117994-64-6C17H22N2O2S