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Murcko scaffold

Ring system with 3 rings and 16 atoms

9 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
16
Chemicals
9
With full pages
3
Scaffold SMILES

c1ccc(-n2ncc3c2CCCCC3)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(-n2ncc3c2CCCCC3)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 9 of 9 chemicals

1-(4-Fluorophenyl)-1H,4H,5H,6H,7H,8H-cyclohepta(c)pyrazole-3-carboxylic acid chemical structure, C15H15FN2O2, CAS 923846-56-4
1-(4-Fluorophenyl)-1H,4H,5H,6H,7H,8H-cyclohepta(c)pyrazole-3-carboxylic acid
CAS 923846-56-4C15H15FN2O2
1-(4-Methoxyphenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid chemical structure, C16H18N2O3, CAS 926258-46-0
1-(4-Methoxyphenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid
CAS 926258-46-0C16H18N2O3
1-(2-Chloro-4-fluorophenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid chemical structure, C15H14ClFN2O2, CAS 926269-37-6
1-(2-Chloro-4-fluorophenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid
CAS 926269-37-6C15H14ClFN2O2
1-(5-Fluoro-2-methylphenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid chemical structure, C16H17FN2O2, CAS 926219-42-3
1-(5-Fluoro-2-methylphenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid
CAS 926219-42-3C16H17FN2O2
1-(4-Fluoro-2-methylphenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid chemical structure, C16H17FN2O2, CAS 926240-80-4
1-(4-Fluoro-2-methylphenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid
CAS 926240-80-4C16H17FN2O2
1-Phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[c]pyrazole-3-carboxylic acid chemical structure, C15H16N2O2, CAS 97393-57-2
1-Phenyl-1H,4H,5H,6H,7H,8H-cyclohepta[c]pyrazole-3-carboxylic acid
CAS 97393-57-2C15H16N2O2
1-(3,5-Difluorophenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid chemical structure, C15H14F2N2O2, CAS 926208-39-1
1-(3,5-Difluorophenyl)-1,4,5,6,7,8-hexahydrocyclohepta[C]pyrazole-3-carboxylic acid
CAS 926208-39-1C15H14F2N2O2
1-(2,4-Dichlorophenyl)-1H,4H,5H,6H,7H,8H-cyclohepta(c)pyrazole-3-carboxylic acid chemical structure, C15H14Cl2N2O2, CAS 926190-36-5
1-(2,4-Dichlorophenyl)-1H,4H,5H,6H,7H,8H-cyclohepta(c)pyrazole-3-carboxylic acid
CAS 926190-36-5C15H14Cl2N2O2
1-(4-Chlorophenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[c]pyrazole-3-carboxylic acid chemical structure, C15H15ClN2O2, CAS 97438-03-4
1-(4-Chlorophenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[c]pyrazole-3-carboxylic acid
CAS 97438-03-4C15H15ClN2O2