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Murcko scaffold

Ring system with 5 rings and 27 atoms

14 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
27
Chemicals
14
With full pages
2
Scaffold SMILES

c1ccc(-c2cn(-c3ccccc3)c3ncnc(N4CCCCC4)c23)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(-c2cn(-c3ccccc3)c3ncnc(N4CCCCC4)c23)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 14 of 14 chemicals

1-[7-(3-Chlorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide chemical structure, C24H22ClN5O, CAS 477239-73-9
1-[7-(3-Chlorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide
CAS 477239-73-9C24H22ClN5O
1-(5,7-Diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide chemical structure, C24H23N5O, CAS 477238-45-2
1-(5,7-Diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide
CAS 477238-45-2C24H23N5O
1-[7-(4-Methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide chemical structure, C25H25N5O2, CAS 477236-25-2
1-[7-(4-Methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide
CAS 477236-25-2C25H25N5O2
1-[7-(4-Ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide chemical structure, C26H27N5O2, CAS 477241-82-0
1-[7-(4-Ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxamide
CAS 477241-82-0C26H27N5O2
Ethyl 1-(5-phenyl-7-(3-(trifluoromethyl)phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate chemical structure, C27H25F3N4O2, CAS 477242-34-5
Ethyl 1-(5-phenyl-7-(3-(trifluoromethyl)phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate
CAS 477242-34-5C27H25F3N4O2
Ethyl 1-[7-(4-bromophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate chemical structure, C26H25BrN4O2, CAS 477240-73-6
Ethyl 1-[7-(4-bromophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate
CAS 477240-73-6C26H25BrN4O2
7-(4-Bromophenyl)-4-(3,5-dimethylpiperidin-1-yl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine chemical structure, C25H25BrN4, CAS 477240-77-0
7-(4-Bromophenyl)-4-(3,5-dimethylpiperidin-1-yl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
CAS 477240-77-0C25H25BrN4
4-(4-Methylpiperidin-1-yl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidine chemical structure, C25H23F3N4, CAS 477242-32-3
4-(4-Methylpiperidin-1-yl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidine
CAS 477242-32-3C25H23F3N4
4-(3,5-Dimethylpiperidin-1-yl)-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine chemical structure, C26H28N4O, CAS 477236-33-2
4-(3,5-Dimethylpiperidin-1-yl)-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
CAS 477236-33-2C26H28N4O
1-(5,7-Diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N,N-diethylpiperidine-3-carboxamide chemical structure, C28H31N5O, CAS 477238-47-4
1-(5,7-Diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-N,N-diethylpiperidine-3-carboxamide
CAS 477238-47-4C28H31N5O
7-(4-Bromophenyl)-5-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine chemical structure, C23H21BrN4, CAS 477240-69-0
7-(4-Bromophenyl)-5-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine
CAS 477240-69-0C23H21BrN4
Ethyl 1-(5,7-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate chemical structure, C26H26N4O2, CAS 477238-43-0
Ethyl 1-(5,7-diphenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxylate
CAS 477238-43-0C26H26N4O2
7-(4-Chlorophenyl)-4-(4-methylpiperidin-1-yl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine chemical structure, C24H23ClN4, CAS 477239-39-7
7-(4-Chlorophenyl)-4-(4-methylpiperidin-1-yl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
CAS 477239-39-7C24H23ClN4
4-(3,5-Dimethylpiperidin-1-yl)-7-(4-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine chemical structure, C25H25FN4, CAS 477240-26-9
4-(3,5-Dimethylpiperidin-1-yl)-7-(4-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
CAS 477240-26-9C25H25FN4