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Murcko scaffold

Ring system with 4 rings and 29 atoms

10 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
29
Chemicals
10
With full pages
3
Scaffold SMILES

O=C(Nc1ccccc1)Nc1cc(Nc2ccc(N3CCNCC3)cc2)ncn1

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 O=C(Nc1ccccc1)Nc1cc(Nc2ccc(N3CCNCC3)cc2)ncn1

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 10 of 10 chemicals

Fgfr-IN-12 chemical structure, C24H27Cl2N7O3, CAS 943189-02-4
Fgfr-IN-12
CAS 943189-02-4C24H27Cl2N7O3
Infigratinib chemical structure, C26H31Cl2N7O3, CAS 872511-34-7
Infigratinib
CAS 872511-34-7C26H31Cl2N7O3
Infigratinib monohydrate chemical structure, C26H33Cl2N7O4, CAS 1310746-11-2
Infigratinib monohydrate
CAS 1310746-11-2C26H33Cl2N7O4
Infigratinib hydrochloride chemical structure, C26H32Cl3N7O3, CAS 1310746-15-6
Infigratinib hydrochloride
CAS 1310746-15-6C26H32Cl3N7O3
Infigratinib phosphate chemical structure, C26H34Cl2N7O7P, CAS 1310746-10-1
Infigratinib phosphate
CAS 1310746-10-1C26H34Cl2N7O7P
Infigratinib mesylate chemical structure, C27H35Cl2N7O6S, CAS 1310746-12-3
Infigratinib mesylate
CAS 1310746-12-3C27H35Cl2N7O6S
Infigratinib acetate chemical structure, C28H35Cl2N7O5, CAS 1310746-17-8
Infigratinib acetate
CAS 1310746-17-8C28H35Cl2N7O5
2-Propenamide, N-(2-((6-((((2,6-dichloro-3,5-dimethoxyphenyl)amino)carbonyl)methylamino)-4-pyrimidinyl)amino)-5-(4-ethyl-1-piperazinyl)phenyl)- chemical structure, C29H34Cl2N8O4, CAS 1702259-66-2
2-Propenamide, N-(2-((6-((((2,6-dichloro-3,5-dimethoxyphenyl)amino)carbonyl)methylamino)-4-pyrimidinyl)amino)-5-(4-ethyl-1-piperazinyl)phenyl)-
CAS 1702259-66-2C29H34Cl2N8O4
2-[4-[4-[[6-[3-(2,6-Dichloro-3,5-dimethoxyphenyl)-1-methylureido]-4-pyrimidinyl]amino]phenyl]-1-piperazinyl]acetic Acid chemical structure, C26H29Cl2N7O5, CAS 2504949-84-0
2-[4-[4-[[6-[3-(2,6-Dichloro-3,5-dimethoxyphenyl)-1-methylureido]-4-pyrimidinyl]amino]phenyl]-1-piperazinyl]acetic Acid
CAS 2504949-84-0C26H29Cl2N7O5
Infigratinib-Boc chemical structure, C29H35Cl2N7O5, CAS 2504949-83-9
Infigratinib-Boc
CAS 2504949-83-9C29H35Cl2N7O5