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Murcko scaffold

Ring system with 4 rings and 21 atoms

4 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
21
Chemicals
4
With full pages
1
Scaffold SMILES

c1ccc(C2Nc3ccccc3-c3nncnc3O2)nc1

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 c1ccc(C2Nc3ccccc3-c3nncnc3O2)nc1

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

10-Bromo-3-butylsulfanyl-6-pyridin-2-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine chemical structure, C19H18BrN5OS, CAS 354778-68-0
10-Bromo-3-butylsulfanyl-6-pyridin-2-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
CAS 354778-68-0C19H18BrN5OS
10-Bromo-3-butylsulfanyl-6-(6-methylpyridin-2-yl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine chemical structure, C20H20BrN5OS, CAS 354778-71-5
10-Bromo-3-butylsulfanyl-6-(6-methylpyridin-2-yl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
CAS 354778-71-5C20H20BrN5OS
1-(3-Methylsulfanyl-6-pyridin-2-yl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl)ethanone chemical structure, C18H15N5O2S, CAS 353518-48-6
1-(3-Methylsulfanyl-6-pyridin-2-yl-6H-[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7-yl)ethanone
CAS 353518-48-6C18H15N5O2S
3-Butylsulfanyl-6-(6-methylpyridin-2-yl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine chemical structure, C20H21N5OS, CAS 354540-72-0
3-Butylsulfanyl-6-(6-methylpyridin-2-yl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine
CAS 354540-72-0C20H21N5OS