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Murcko scaffold

Ring system with 3 rings and 25 atoms

5 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
25
Chemicals
5
With full pages
2
Scaffold SMILES

O=C(OCCNCc1ccccc1)c1cnccc1-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=C(OCCNCc1ccccc1)c1cnccc1-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 5 of 5 chemicals

2-(N-Benzyl-N-methylamino)ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate chemical structure, C26H27N3O6, CAS 59875-58-0
2-(N-Benzyl-N-methylamino)ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate
CAS 59875-58-0C26H27N3O6
Dehydro nicardipine hydrochloride chemical structure, C26H28ClN3O6, CAS 69441-29-8
Dehydro nicardipine hydrochloride
CAS 69441-29-8C26H28ClN3O6
3-Methyl 5-[Methyl(phenylmethyl)amino]ethyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate Dihydrochloride chemical structure, C26H29Cl2N3O6, CAS 2724726-76-3
3-Methyl 5-[Methyl(phenylmethyl)amino]ethyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate Dihydrochloride
CAS 2724726-76-3C26H29Cl2N3O6
3-(2-(Benzylamino)ethyl) 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate chemical structure, C25H25N3O6, CAS 1202017-92-2
3-(2-(Benzylamino)ethyl) 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate
CAS 1202017-92-2C25H25N3O6
Nicardipine impurity 58 chemical structure, C26H27N3O7, CAS 1851279-61-2
Nicardipine impurity 58
CAS 1851279-61-2C26H27N3O7