CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 20 atoms

7 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
20
Chemicals
7
With full pages
4
Scaffold SMILES

O=C1CCN(c2ccccc2)C(=Nc2ncccn2)N1

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=C1CCN(c2ccccc2)C(=Nc2ncccn2)N1

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 7 of 7 chemicals

2-[(4,6-Dimethylpyrimidin-2-yl)amino]-3-(3-methylphenyl)-6-oxo-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid chemical structure, C18H19N5O3, CAS 1009237-10-8
2-[(4,6-Dimethylpyrimidin-2-yl)amino]-3-(3-methylphenyl)-6-oxo-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid
CAS 1009237-10-8C18H19N5O3
2-[(4,6-Dimethylpyrimidin-2-yl)amino]-6-oxo-3-[3-(trifluoromethyl)phenyl]-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid chemical structure, C18H16F3N5O3, CAS 1009554-15-7
2-[(4,6-Dimethylpyrimidin-2-yl)amino]-6-oxo-3-[3-(trifluoromethyl)phenyl]-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid
CAS 1009554-15-7C18H16F3N5O3
3-(3,4-Dimethylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxo-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid chemical structure, C19H21N5O3, CAS 1009500-37-1
3-(3,4-Dimethylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxo-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid
CAS 1009500-37-1C19H21N5O3
3-(2,4-Dichlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxo-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid chemical structure, C17H15Cl2N5O3, CAS 1008977-85-2
3-(2,4-Dichlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxo-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid
CAS 1008977-85-2C17H15Cl2N5O3
3-(3,4-Dimethylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)imino-6-oxo-1,3-diazinane-4-carboxylic acid chemical structure, C19H21N5O3
3-(3,4-Dimethylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)imino-6-oxo-1,3-diazinane-4-carboxylic acid
C19H21N5O3
3-(3-Chlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxo-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid chemical structure, C17H16ClN5O3, CAS 1009552-56-0
3-(3-Chlorophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-6-oxo-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid
CAS 1009552-56-0C17H16ClN5O3
3-(4-Chlorophenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)amino]-3,4,5,6-tetrahydro-6-oxo-4-pyrimidinecarboxylic acid chemical structure, C17H16ClN5O3, CAS 1008859-22-0
3-(4-Chlorophenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)amino]-3,4,5,6-tetrahydro-6-oxo-4-pyrimidinecarboxylic acid
CAS 1008859-22-0C17H16ClN5O3