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Murcko scaffold

Ring system with 3 rings and 20 atoms

4 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
20
Chemicals
4
With full pages
1
Scaffold SMILES

O=C(NCc1cc2ccccc2o1)Nc1cncnc1

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(NCc1cc2ccccc2o1)Nc1cncnc1

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 4 of 4 chemicals

1-(2-Aminopyrimidin-5-yl)-3-[(1S)-1-(5,7-difluoro-3-methyl-1-benzofuran-2-yl)-2,2,2-trifluoroethyl]urea chemical structure, C16H12F5N5O2, CAS 2883540-91-6
1-(2-Aminopyrimidin-5-yl)-3-[(1S)-1-(5,7-difluoro-3-methyl-1-benzofuran-2-yl)-2,2,2-trifluoroethyl]urea
CAS 2883540-91-6C16H12F5N5O2
Tersolisib chemical structure, C16H12F5N5O2, CAS 2883540-92-7
Tersolisib
CAS 2883540-92-7C16H12F5N5O2
1-(2-Aminopyrimidin-5-yl)-3-(1-(5,7-difluoro-3-methylbenzofuran-2-yl)-2,2,2-trifluoroethyl)urea chemical structure, C16H12F5N5O2, CAS 2883543-54-0
1-(2-Aminopyrimidin-5-yl)-3-(1-(5,7-difluoro-3-methylbenzofuran-2-yl)-2,2,2-trifluoroethyl)urea
CAS 2883543-54-0C16H12F5N5O2
(R)-1-(2-Chloropyrimidin-5-yl)-3-[1-(5,7-difluoro-3-methylbenzofuran-2-yl)-2,2,2-trifluoroethyl]urea chemical structure, C16H10ClF5N4O2, CAS 2883546-90-3
(R)-1-(2-Chloropyrimidin-5-yl)-3-[1-(5,7-difluoro-3-methylbenzofuran-2-yl)-2,2,2-trifluoroethyl]urea
CAS 2883546-90-3C16H10ClF5N4O2