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Murcko scaffold

Ring system with 3 rings and 17 atoms

11 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
11
With full pages
10
Scaffold SMILES

O=C1CCCC2=C1C(c1cccnc1)C=CN2

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=C1CCCC2=C1C(c1cccnc1)C=CN2

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 11 of 11 chemicals

2,7,7-Trimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile chemical structure, C18H19N3O, CAS 5707-35-7
2,7,7-Trimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
CAS 5707-35-7C18H19N3O
Ethyl 2,7,7-trimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate chemical structure, C20H24N2O3, CAS 5136-15-2
Ethyl 2,7,7-trimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
CAS 5136-15-2C20H24N2O3
Ethyl 2-methyl-5-oxo-4-(3-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate chemical structure, C18H20N2O3, CAS 34779-73-2
Ethyl 2-methyl-5-oxo-4-(3-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
CAS 34779-73-2C18H20N2O3
Propan-2-yl 2-methyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate chemical structure, C19H22N2O3, CAS 299407-70-8
Propan-2-yl 2-methyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
CAS 299407-70-8C19H22N2O3
2-Methyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile chemical structure, C16H15N3O, CAS 314052-29-4
2-Methyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
CAS 314052-29-4C16H15N3O
2-Amino-1-(dimethylamino)-7,7-dimethyl-5-oxo-4-(3-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile chemical structure, C19H23N5O, CAS 496787-23-6
2-Amino-1-(dimethylamino)-7,7-dimethyl-5-oxo-4-(3-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
CAS 496787-23-6C19H23N5O
Isopropyl 2,7,7-trimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate chemical structure, C21H26N2O3, CAS 298706-80-6
Isopropyl 2,7,7-trimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
CAS 298706-80-6C21H26N2O3
2-(Propan-2-yloxy)ethyl 2-methyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate chemical structure, C21H26N2O4, CAS 312620-09-0
2-(Propan-2-yloxy)ethyl 2-methyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
CAS 312620-09-0C21H26N2O4
Methyl 4-(2,6-dichloro-3-pyridinyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate chemical structure, C19H20Cl2N2O3, CAS 853331-92-7
Methyl 4-(2,6-dichloro-3-pyridinyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
CAS 853331-92-7C19H20Cl2N2O3
Ethyl 4-(2,6-dichloro-3-pyridinyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate chemical structure, C20H22Cl2N2O3, CAS 853333-06-9
Ethyl 4-(2,6-dichloro-3-pyridinyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
CAS 853333-06-9C20H22Cl2N2O3
4-(2,6-Dichloro-3-pyridinyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile chemical structure, C18H17Cl2N3O, CAS 853333-14-9
4-(2,6-Dichloro-3-pyridinyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
CAS 853333-14-9C18H17Cl2N3O