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Murcko scaffold

Ring system with 4 rings and 25 atoms

5 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
25
Chemicals
5
With full pages
3
Scaffold SMILES

c1ccc(C(c2ccccc2)N2CCN(c3ncncn3)CC2)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(c2ccccc2)N2CCN(c3ncncn3)CC2)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 5 of 5 chemicals

Almitrine chemical structure, C26H29F2N7, CAS 27469-53-0
Almitrine
CAS 27469-53-0C26H29F2N7
Almitrine monomethanesulfonate chemical structure, C27H33F2N7O3S, CAS 106648-10-6
Almitrine monomethanesulfonate
CAS 106648-10-6C27H33F2N7O3S
Almitrine-raubasine chemical structure, C47H53F2N9O3, CAS 76997-30-3
Almitrine-raubasine
CAS 76997-30-3C47H53F2N9O3
Almitrine mesylate chemical structure, C28H37F2N7O6S2, CAS 29608-49-9
Almitrine mesylate
CAS 29608-49-9C28H37F2N7O6S2
6-[4-[Bis(4-fluorophenyl)methyl]-1-piperazinyl]-N2,N4-bis(3-chloro-2-propen-1-yl)-1,3,5-triazine-2,4-diamine chemical structure, C26H27Cl2F2N7, CAS 59454-82-9
6-[4-[Bis(4-fluorophenyl)methyl]-1-piperazinyl]-N2,N4-bis(3-chloro-2-propen-1-yl)-1,3,5-triazine-2,4-diamine
CAS 59454-82-9C26H27Cl2F2N7