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Murcko scaffold

Ring system with 3 rings and 18 atoms

8 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
8
With full pages
3
Scaffold SMILES

c1ccc(CNC2CCNc3ccccc32)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(CNC2CCNc3ccccc32)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 8 of 8 chemicals

Torcetrapib chemical structure, C26H25F9N2O4, CAS 262352-17-0
Torcetrapib
CAS 262352-17-0C26H25F9N2O4
CP-532623 chemical structure, C27H27F9N2O3, CAS 261947-38-0
CP-532623
CAS 261947-38-0C27H27F9N2O3
CP 524515, >=98% (Hplc) chemical structure, C27H27F9N2O4, CAS 262352-13-6
CP 524515, >=98% (Hplc)
CAS 262352-13-6C27H27F9N2O4
Torcetrapib metabolite M12 chemical structure, C26H25F9N2O5, CAS 262352-15-8
Torcetrapib metabolite M12
CAS 262352-15-8C26H25F9N2O5
Torcetrapib ethanolate chemical structure, C28H31F9N2O5, CAS 343798-00-5
Torcetrapib ethanolate
CAS 343798-00-5C28H31F9N2O5
Torcetrapib metabolite M24 chemical structure, C21H19F9N2, CAS 1093621-77-2
Torcetrapib metabolite M24
CAS 1093621-77-2C21H19F9N2
DE(ethoxycarbonyl)torcetrapib chemical structure, C23H21F9N2O2, CAS 849818-43-5
DE(ethoxycarbonyl)torcetrapib
CAS 849818-43-5C23H21F9N2O2
Torcetrapib metabolite M13 chemical structure, C26H23F9N2O6, CAS 849818-41-3
Torcetrapib metabolite M13
CAS 849818-41-3C26H23F9N2O6