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Murcko scaffold

Ring system with 4 rings and 18 atoms

4 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
18
Chemicals
4
With full pages
1
Scaffold SMILES

c1ccc2c(c1)[nH]c1nc(-n3cccn3)nnc12

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 c1ccc2c(c1)[nH]c1nc(-n3cccn3)nnc12

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 4 of 4 chemicals

3-(3,5-Dimethyl-1H-pyrazol-1-yl)-5-ethyl-5H-[1,2,4]triazino[5,6-b]indole chemical structure, C16H16N6, CAS 112800-80-3
3-(3,5-Dimethyl-1H-pyrazol-1-yl)-5-ethyl-5H-[1,2,4]triazino[5,6-b]indole
CAS 112800-80-3C16H16N6
3-(3,5-Dimethylpyrazol-1-yl)-5-methyl-[1,2,4]triazino[5,6-b]indole chemical structure, C15H14N6, CAS 311813-63-5
3-(3,5-Dimethylpyrazol-1-yl)-5-methyl-[1,2,4]triazino[5,6-b]indole
CAS 311813-63-5C15H14N6
8-Bromo-3-(3,5-dimethylpyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indole chemical structure, C14H11BrN6, CAS 312308-87-5
8-Bromo-3-(3,5-dimethylpyrazol-1-yl)-5H-[1,2,4]triazino[5,6-b]indole
CAS 312308-87-5C14H11BrN6
3,5-Dimethyl-1-{5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}-1H-pyrazole chemical structure, C17H18N6, CAS 1223395-54-7
3,5-Dimethyl-1-{5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}-1H-pyrazole
CAS 1223395-54-7C17H18N6