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Murcko scaffold

Ring system with 4 rings and 29 atoms

5 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
29
Chemicals
5
With full pages
1
Scaffold SMILES

O=C(CSc1nc2ccccc2c(=O)n1CCc1ccccc1)c1ccccc1

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(CSc1nc2ccccc2c(=O)n1CCc1ccccc1)c1ccccc1

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 5 of 5 chemicals

2-((2-(4-Chlorophenyl)-2-oxoethyl)thio)-3-phenethylquinazolin-4(3H)-one chemical structure, C24H19ClN2O2S, CAS 403722-96-3
2-((2-(4-Chlorophenyl)-2-oxoethyl)thio)-3-phenethylquinazolin-4(3H)-one
CAS 403722-96-3C24H19ClN2O2S
2-((2-(4-Chlorophenyl)-2-oxoethyl)thio)-3-(3,4-dimethoxyphenethyl)quinazolin-4(3H)-one chemical structure, C26H23ClN2O4S, CAS 443347-94-2
2-((2-(4-Chlorophenyl)-2-oxoethyl)thio)-3-(3,4-dimethoxyphenethyl)quinazolin-4(3H)-one
CAS 443347-94-2C26H23ClN2O4S
Egfr/her2/cdk9-IN-3 chemical structure, C24H21N3O4S2, CAS 422276-47-9
Egfr/her2/cdk9-IN-3
CAS 422276-47-9C24H21N3O4S2
2-{[2-(2,5-Dimethylphenyl)-2-oxoethyl]sulfanyl}-4-oxo-3-(2-phenylethyl)-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide chemical structure, C30H31N3O3S, CAS 1113129-06-8
2-{[2-(2,5-Dimethylphenyl)-2-oxoethyl]sulfanyl}-4-oxo-3-(2-phenylethyl)-N-(propan-2-yl)-3,4-dihydroquinazoline-7-carboxamide
CAS 1113129-06-8C30H31N3O3S
2-{[2-(4-Methylphenyl)-2-oxoethyl]sulfanyl}-N-(2-methylpropyl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide chemical structure, C30H31N3O3S, CAS 1113139-21-1
2-{[2-(4-Methylphenyl)-2-oxoethyl]sulfanyl}-N-(2-methylpropyl)-4-oxo-3-(2-phenylethyl)-3,4-dihydroquinazoline-7-carboxamide
CAS 1113139-21-1C30H31N3O3S