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Murcko scaffold

Diquat scaffold

9 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
14
Chemicals
9
With full pages
5
Scaffold SMILES

c1cc[n+]2c(c1)-c1cccc[n+]1CC2

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 scaffoldOpen the Diquat page
Murcko scaffold c1cc[n+]2c(c1)-c1cccc[n+]1CC2

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 9 of 9 chemicals

Diquat dibromide chemical structure, C12H12Br2N2, CAS 85-00-7
Diquat dibromide
CAS 85-00-7C12H12Br2N2
Diquat chemical structure, C12H12N2+2, CAS 2764-72-9
Diquat
CAS 2764-72-9C12H12N2+2
Diquat dichloride chemical structure, C12H12Cl2N2, CAS 4032-26-2
Diquat dichloride
CAS 4032-26-2C12H12Cl2N2
6,7-Dihydrodipyrido(1,2-a:2',1'-c)pyrazidinium diiodide chemical structure, C12H12I2N2, CAS 25179-26-4
6,7-Dihydrodipyrido(1,2-a:2',1'-c)pyrazidinium diiodide
CAS 25179-26-4C12H12I2N2
Diquat dibromide monohydrate chemical structure, C12H14Br2N2O, CAS 6385-62-2
Diquat dibromide monohydrate
CAS 6385-62-2C12H14Br2N2O
Cleansweep chemical structure, C24H26N4+4, CAS 58748-08-6
Cleansweep
CAS 58748-08-6C24H26N4+4
7,10-Diazoniatricyclo[8.4.0.02,7]tetradeca-1(14),2,4,6,10,12-hexaene dihexafluorophosphate chemical structure, C12H12F12N2P2, CAS 67994-94-9
7,10-Diazoniatricyclo[8.4.0.02,7]tetradeca-1(14),2,4,6,10,12-hexaene dihexafluorophosphate
CAS 67994-94-9C12H12F12N2P2
6,7-Dihydrodipyrido(1,2-a:2',1'-c)pyrazinediylium dihydroxide chemical structure, C12H14N2O2, CAS 94021-76-8
6,7-Dihydrodipyrido(1,2-a:2',1'-c)pyrazinediylium dihydroxide
CAS 94021-76-8C12H14N2O2
3,10-Dimethyl-6,7-dihydrodipyrido[1,2-a:2',1'-c]pyrazine-5,8-diium bromide chemical structure, C14H16Br2N2, CAS 4150-50-9
3,10-Dimethyl-6,7-dihydrodipyrido[1,2-a:2',1'-c]pyrazine-5,8-diium bromide
CAS 4150-50-9C14H16Br2N2