CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 21 atoms

6 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
6
With full pages
2
Scaffold SMILES

O=c1[nH]c(=Cc2c[nH]cn2)c(=O)[nH]c1=Cc1ccccc1

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(=Cc2c[nH]cn2)c(=O)[nH]c1=Cc1ccccc1

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 6 of 6 chemicals

(3Z,6Z)-3-[[5-(1,1-Dimethyl-2-propen-1-yl)-1H-imidazol-4-yl]methylene]-6-(phenylmethylene)-2,5-piperazinedione chemical structure, C20H20N4O2, CAS 351325-37-6
(3Z,6Z)-3-[[5-(1,1-Dimethyl-2-propen-1-yl)-1H-imidazol-4-yl]methylene]-6-(phenylmethylene)-2,5-piperazinedione
CAS 351325-37-6C20H20N4O2
Plinabulin chemical structure, C19H20N4O2, CAS 714272-27-2
Plinabulin
CAS 714272-27-2C19H20N4O2
(3Z,6Z)-3-[[5-(1,1-Dimethyl-2-propen-1-yl)-1H-imidazol-4-yl]methylene]-6-[(4-methoxyphenyl)methylene]-2,5-piperazinedione chemical structure, C21H22N4O3, CAS 1056465-31-6
(3Z,6Z)-3-[[5-(1,1-Dimethyl-2-propen-1-yl)-1H-imidazol-4-yl]methylene]-6-[(4-methoxyphenyl)methylene]-2,5-piperazinedione
CAS 1056465-31-6C21H22N4O3
(3Z,6Z)-3-[[5-(1,1-Dimethylethyl)-1H-imidazol-4-yl]methylene]-6-[(4-methoxyphenyl)methylene]-2,5-piperazinedione chemical structure, C20H22N4O3, CAS 714272-28-3
(3Z,6Z)-3-[[5-(1,1-Dimethylethyl)-1H-imidazol-4-yl]methylene]-6-[(4-methoxyphenyl)methylene]-2,5-piperazinedione
CAS 714272-28-3C20H22N4O3
3-(5-tert-Butyl-1H-imidazol-4-ylmethylene)-6-(3-fluoro-benzylidene)-piperazine-2,5-dione chemical structure, C19H19FN4O2, CAS 2135339-46-5
3-(5-tert-Butyl-1H-imidazol-4-ylmethylene)-6-(3-fluoro-benzylidene)-piperazine-2,5-dione
CAS 2135339-46-5C19H19FN4O2
Plinabulin-d1 chemical structure, C19H20N4O2, CAS 2054938-28-0
Plinabulin-d1
CAS 2054938-28-0C19H20N4O2