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Murcko scaffold

Ring system with 4 rings and 19 atoms

12 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
19
Chemicals
12
With full pages
3
Scaffold SMILES

c1ccc(-c2nnc3n2CCc2ccccc2-3)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(-c2nnc3n2CCc2ccccc2-3)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 12 of 12 chemicals

5,5-Dimethyl-3-(2-methylphenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline chemical structure, C19H19N3, CAS 147567-59-7
5,5-Dimethyl-3-(2-methylphenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline
CAS 147567-59-7C19H19N3
7,10-Dimethoxy-5,5-dimethyl-3-phenyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline chemical structure, C20H21N3O2, CAS 312502-25-3
7,10-Dimethoxy-5,5-dimethyl-3-phenyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline
CAS 312502-25-3C20H21N3O2
1,2,4-Triazolo[3,4-a]isoquinoline, 5,6-dihydro-5,5-dimethyl-3-phenyl- chemical structure, C18H17N3, CAS 147567-56-4
1,2,4-Triazolo[3,4-a]isoquinoline, 5,6-dihydro-5,5-dimethyl-3-phenyl-
CAS 147567-56-4C18H17N3
5,5-Dimethyl-3-(2-nitrophenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline chemical structure, C18H16N4O2, CAS 147567-58-6
5,5-Dimethyl-3-(2-nitrophenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline
CAS 147567-58-6C18H16N4O2
3-(4-Methoxyphenyl)-5,5,8,9-tetramethyl-5,6-dihydro[1,2,4]triazolo[3,4-a]isoquinoline chemical structure, C21H23N3O, CAS 5537-35-9
3-(4-Methoxyphenyl)-5,5,8,9-tetramethyl-5,6-dihydro[1,2,4]triazolo[3,4-a]isoquinoline
CAS 5537-35-9C21H23N3O
3-(5,5-Dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinolin-3-yl)aniline chemical structure, C18H18N4, CAS 302553-49-7
3-(5,5-Dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinolin-3-yl)aniline
CAS 302553-49-7C18H18N4
3-(5,5-Dimethyl-5,6-dihydro[1,2,4]triazolo[3,4-a]isoquinolin-3-yl)phenol chemical structure, C18H17N3O, CAS 330998-71-5
3-(5,5-Dimethyl-5,6-dihydro[1,2,4]triazolo[3,4-a]isoquinolin-3-yl)phenol
CAS 330998-71-5C18H17N3O
3-(2-Chlorophenyl)-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline chemical structure, C18H16ClN3, CAS 301352-48-7
3-(2-Chlorophenyl)-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline
CAS 301352-48-7C18H16ClN3
5,5-Dimethyl-3-(4-methylphenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline chemical structure, C19H19N3, CAS 302802-01-3
5,5-Dimethyl-3-(4-methylphenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline
CAS 302802-01-3C19H19N3
3-(4-Bromophenyl)-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline chemical structure, C18H16BrN3, CAS 147567-57-5
3-(4-Bromophenyl)-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline
CAS 147567-57-5C18H16BrN3
3-(4-Bromophenyl)-8,9-dimethoxy-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline chemical structure, C20H20BrN3O2, CAS 301352-52-3
3-(4-Bromophenyl)-8,9-dimethoxy-5,5-dimethyl-6H-[1,2,4]triazolo[3,4-a]isoquinoline
CAS 301352-52-3C20H20BrN3O2
5,5-Dimethyl-3-(3,4,5-trimethoxyphenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline chemical structure, C21H23N3O3, CAS 314030-62-1
5,5-Dimethyl-3-(3,4,5-trimethoxyphenyl)-6H-[1,2,4]triazolo[3,4-a]isoquinoline
CAS 314030-62-1C21H23N3O3