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Murcko scaffold

Ring system with 5 rings and 17 atoms

64 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
17
Chemicals
64
With full pages
11
Scaffold SMILES

O=C1C2CN3CC1CN(C2)C3c1ccccc1

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=C1C2CN3CC1CN(C2)C3c1ccccc1

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 48 of 64 chemicals

2-(2,4-Dihydroxyphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C16H20N2O3, CAS 108790-66-5
2-(2,4-Dihydroxyphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 108790-66-5C16H20N2O3
1,3-Diazaadamantan-6-one, 2-(4-methoxyphenyl)-5,7-dimethyl- chemical structure, C17H22N2O2, CAS 108790-63-2
1,3-Diazaadamantan-6-one, 2-(4-methoxyphenyl)-5,7-dimethyl-
CAS 108790-63-2C17H22N2O2
1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl- chemical structure, C16H20N2O2, CAS 108790-56-3
1,3-Diazaadamantan-6-one, 2-(2-hydroxyphenyl)-5,7-dimethyl-
CAS 108790-56-3C16H20N2O2
1,3-Diazadamantan-6-one, 5,7-dimethyl-2-phenyl- chemical structure, C16H20N2O, CAS 108790-55-2
1,3-Diazadamantan-6-one, 5,7-dimethyl-2-phenyl-
CAS 108790-55-2C16H20N2O
1,3-Diazatricyclo(3.3.1.1(sup 3,7))decan-6-one, 5,7-dimethyl-2-(4-hydroxyphenyl)- chemical structure, C16H20N2O2, CAS 108790-62-1
1,3-Diazatricyclo(3.3.1.1(sup 3,7))decan-6-one, 5,7-dimethyl-2-(4-hydroxyphenyl)-
CAS 108790-62-1C16H20N2O2
1,3-Diazaadamantan-6-one, 5,7-dimethyl-2-(4-dimethylaminophenyl)- chemical structure, C18H25N3O, CAS 108790-64-3
1,3-Diazaadamantan-6-one, 5,7-dimethyl-2-(4-dimethylaminophenyl)-
CAS 108790-64-3C18H25N3O
5,7-Diethyl-2-{4-nitrophenyl}-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C18H23N3O3, CAS 387383-37-1
5,7-Diethyl-2-{4-nitrophenyl}-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 387383-37-1C18H23N3O3
2-Phenyl-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C20H28N2O, CAS 381209-60-5
2-Phenyl-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 381209-60-5C20H28N2O
5,7-Diethyl-2-(4-methoxyphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C19H26N2O2, CAS 312626-18-9
5,7-Diethyl-2-(4-methoxyphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 312626-18-9C19H26N2O2
2-(4-Chlorophenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C16H19ClN2O, CAS 108790-59-6
2-(4-Chlorophenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 108790-59-6C16H19ClN2O
2-(4-Fluorophenyl)-5,7-diisopropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C20H27FN2O, CAS 488706-52-1
2-(4-Fluorophenyl)-5,7-diisopropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 488706-52-1C20H27FN2O
2-(4-Fluorophenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C20H27FN2O, CAS 432005-78-2
2-(4-Fluorophenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 432005-78-2C20H27FN2O
2-(4-Isopropoxyphenyl)-5,7-dimethyl-1,3-diazaadamantan-6-one chemical structure, C19H26N2O2, CAS 432019-25-5
2-(4-Isopropoxyphenyl)-5,7-dimethyl-1,3-diazaadamantan-6-one
CAS 432019-25-5C19H26N2O2
5,7-Diethyl-2-(4-isopropoxyphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C21H30N2O2, CAS 443322-48-3
5,7-Diethyl-2-(4-isopropoxyphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 443322-48-3C21H30N2O2
2-(2-Methylphenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C21H30N2O, CAS 499141-68-3
2-(2-Methylphenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 499141-68-3C21H30N2O
2-(4-Isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantan-6-one chemical structure, C19H26N2O, CAS 672895-06-6
2-(4-Isopropylphenyl)-5,7-dimethyl-1,3-diazaadamantan-6-one
CAS 672895-06-6C19H26N2O
5,7-Diethyl-2-(4-isopropylphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C21H30N2O, CAS 664968-29-0
5,7-Diethyl-2-(4-isopropylphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 664968-29-0C21H30N2O
5,7-Dimethyl-2-(4-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C16H19N3O3, CAS 5705-34-0
5,7-Dimethyl-2-(4-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 5705-34-0C16H19N3O3
2-(2-Fluorophenyl)-5,7-diisopropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C20H27FN2O, CAS 448911-35-1
2-(2-Fluorophenyl)-5,7-diisopropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 448911-35-1C20H27FN2O
2-(2,4-Dichlorophenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C16H18Cl2N2O, CAS 487038-67-5
2-(2,4-Dichlorophenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 487038-67-5C16H18Cl2N2O
2-(4-Bromophenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C16H19BrN2O, CAS 108790-60-9
2-(4-Bromophenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 108790-60-9C16H19BrN2O
2-(4-Methoxyphenyl)-5-methyl-7-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C19H26N2O2, CAS 955961-55-4
2-(4-Methoxyphenyl)-5-methyl-7-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 955961-55-4C19H26N2O2
5,7-Dimethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C16H19N3O3, CAS 108790-58-5
5,7-Dimethyl-2-(3-nitrophenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 108790-58-5C16H19N3O3
2-(4-Hydroxy-3-methoxyphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one chemical structure, C17H22N2O3, CAS 108790-67-6
2-(4-Hydroxy-3-methoxyphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
CAS 108790-67-6C17H22N2O3