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Murcko scaffold

Ring system with 3 rings and 21 atoms

10 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
10
With full pages
4
Scaffold SMILES

c1ccc(CNc2ccnc(Nc3ccccc3)n2)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(CNc2ccnc(Nc3ccccc3)n2)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 10 of 10 chemicals

4-N-Benzyl-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine chemical structure, C17H16N6O2, CAS 372174-71-5
4-N-Benzyl-5-nitro-2-N-phenylpyrimidine-2,4,6-triamine
CAS 372174-71-5C17H16N6O2
N4-benzyl-N2-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine chemical structure, C18H18N6O3, CAS 674814-67-6
N4-benzyl-N2-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
CAS 674814-67-6C18H18N6O3
4-N-Benzyl-2-N-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine chemical structure, C18H18N6O2, CAS 672944-59-1
4-N-Benzyl-2-N-(3-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
CAS 672944-59-1C18H18N6O2
4-N-Benzyl-2-N-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine chemical structure, C18H18N6O2, CAS 29935-93-1
4-N-Benzyl-2-N-(4-methylphenyl)-5-nitropyrimidine-2,4,6-triamine
CAS 29935-93-1C18H18N6O2
N-Methyl-N-(2-((2-(4-(methylsulfonyl)phenylamino)-5-(trifluoromethyl)pyrimidin-4-ylamino)methyl)phenyl)methanesulfonamide chemical structure, C21H22F3N5O4S2, CAS 1095647-95-2
N-Methyl-N-(2-((2-(4-(methylsulfonyl)phenylamino)-5-(trifluoromethyl)pyrimidin-4-ylamino)methyl)phenyl)methanesulfonamide
CAS 1095647-95-2C21H22F3N5O4S2
Jak3-IN-12 chemical structure, C19H19N5O4S, CAS 1430095-86-5
Jak3-IN-12
CAS 1430095-86-5C19H19N5O4S
N4-Benzyl-N2-(4-bromophenyl)-5-fluoropyrimidine-2,4-diamine chemical structure, C17H14BrFN4, CAS 1956323-18-4
N4-Benzyl-N2-(4-bromophenyl)-5-fluoropyrimidine-2,4-diamine
CAS 1956323-18-4C17H14BrFN4
FAK ligand-Linker Conjugate 1 chemical structure, C25H28F3N5O6S, CAS 2307461-45-4
FAK ligand-Linker Conjugate 1
CAS 2307461-45-4C25H28F3N5O6S
N-(3-(((2-((4-Hydroxyphenyl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)amino)methyl)phenyl)-N-methylmethanesulfonamide chemical structure, C20H20F3N5O3S, CAS 2296719-34-9
N-(3-(((2-((4-Hydroxyphenyl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)amino)methyl)phenyl)-N-methylmethanesulfonamide
CAS 2296719-34-9C20H20F3N5O3S
5-[[4-[(3-Amino-4-methylphenyl)methylamino]-2-pyrimidinyl]amino]-2-methylBenzenesulfonamide chemical structure, C19H22N6O2S, CAS 1305208-28-9
5-[[4-[(3-Amino-4-methylphenyl)methylamino]-2-pyrimidinyl]amino]-2-methylBenzenesulfonamide
CAS 1305208-28-9C19H22N6O2S