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Murcko scaffold

Ring system with 4 rings and 25 atoms

4 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
25
Chemicals
4
With full pages
1
Scaffold SMILES

O=c1[nH]c(N2CCCCC2)nc(-c2ccccc2)c1-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=c1[nH]c(N2CCCCC2)nc(-c2ccccc2)c1-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 4 of 4 chemicals

Pulrodemstat chemical structure, C24H23F2N5O2, CAS 1821307-10-1
Pulrodemstat
CAS 1821307-10-1C24H23F2N5O2
Pulrodemstat besilate chemical structure, C30H29F2N5O5S, CAS 2097523-60-7
Pulrodemstat besilate
CAS 2097523-60-7C30H29F2N5O5S
4-(2-(4-Aminopiperidin-1-yl)-5-(3-fluoro-4-methoxyphenyl)-1-methyl-6-oxo-1,6-dihydropyrimidin-4-yl)-2-fluorobenzonitrile xhydrochloride chemical structure, C24H24ClF2N5O2, CAS 1821307-11-2
4-(2-(4-Aminopiperidin-1-yl)-5-(3-fluoro-4-methoxyphenyl)-1-methyl-6-oxo-1,6-dihydropyrimidin-4-yl)-2-fluorobenzonitrile xhydrochloride
CAS 1821307-11-2C24H24ClF2N5O2
Pulrodemstat tosylate chemical structure, C31H31F2N5O5S, CAS 2097523-57-2
Pulrodemstat tosylate
CAS 2097523-57-2C31H31F2N5O5S