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Murcko scaffold

RefChem:382152 scaffold

83 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
18
Chemicals
83
With full pages
15
Scaffold SMILES

O=C1C2C3C=CC(C3)C2C(=O)N1c1ccccc1

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 RefChem:382152 page
Murcko scaffold O=C1C2C3C=CC(C3)C2C(=O)N1c1ccccc1

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 83 chemicals

Ethanaminium, 2-(3-(1,3,3a,4,7,7a-hexahydro-1,3-dioxo-4,7-methano-2H-isoindol-2-yl)phenoxy)-N,N,N-triethyl-, iodide chemical structure, C23H31IN2O3, CAS 69844-09-3
Ethanaminium, 2-(3-(1,3,3a,4,7,7a-hexahydro-1,3-dioxo-4,7-methano-2H-isoindol-2-yl)phenoxy)-N,N,N-triethyl-, iodide
CAS 69844-09-3C23H31IN2O3
4-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N,N-diethylbenzamide chemical structure, C20H22N2O3, CAS 69844-10-6
4-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N,N-diethylbenzamide
CAS 69844-10-6C20H22N2O3
2-(Diethylamino)ethyl 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate--hydrogen chloride (1/1) chemical structure, C22H27ClN2O4, CAS 69844-11-7
2-(Diethylamino)ethyl 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate--hydrogen chloride (1/1)
CAS 69844-11-7C22H27ClN2O4
(Diethylamino)methyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate chemical structure, C21H24N2O4, CAS 69844-12-8
(Diethylamino)methyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
CAS 69844-12-8C21H24N2O4
2-(4-Ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione chemical structure, C17H17NO3, CAS 15247-36-6
2-(4-Ethoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
CAS 15247-36-6C17H17NO3
4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(4-(2-propynyloxy)phenyl)- chemical structure, C18H15NO3, CAS 39488-06-7
4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(4-(2-propynyloxy)phenyl)-
CAS 39488-06-7C18H15NO3
4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(4-(2-oxopropoxy)phenyl)- chemical structure, C18H17NO4, CAS 39488-07-8
4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(4-(2-oxopropoxy)phenyl)-
CAS 39488-07-8C18H17NO4
1,7,8,9,10,10-Hexachloro-4-(4-hydroxyphenyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione chemical structure, C15H7Cl6NO3, CAS 75363-80-3
1,7,8,9,10,10-Hexachloro-4-(4-hydroxyphenyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CAS 75363-80-3C15H7Cl6NO3
2-(3-Hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione chemical structure, C15H13NO3, CAS 116755-72-7
2-(3-Hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
CAS 116755-72-7C15H13NO3
RefChem:382152 chemical structure, C15H13NO2, CAS 26234-46-8
RefChem:382152
CAS 26234-46-8C15H13NO2
1,4,5,6,7,7-Hexachloro-N-(3-methoxyphenyl)-5-norbornene-2,3-dicarboximide chemical structure, C16H9Cl6NO3, CAS 74944-59-5
1,4,5,6,7,7-Hexachloro-N-(3-methoxyphenyl)-5-norbornene-2,3-dicarboximide
CAS 74944-59-5C16H9Cl6NO3
2-(4-Hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione chemical structure, C15H13NO3, CAS 10308-54-0
2-(4-Hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
CAS 10308-54-0C15H13NO3
4-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid chemical structure, C16H13NO4, CAS 55099-10-0
4-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid
CAS 55099-10-0C16H13NO4
2-(5-(Ethylsulfonyl)-2-hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione chemical structure, C17H17NO5S, CAS 360791-51-1
2-(5-(Ethylsulfonyl)-2-hydroxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
CAS 360791-51-1C17H17NO5S
2-(4-Methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione chemical structure, C16H15NO2, CAS 72657-45-5
2-(4-Methylphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
CAS 72657-45-5C16H15NO2
Rel-(3aR,4R,7S,7aS)-2-(p-tolyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione chemical structure, C16H15NO2
Rel-(3aR,4R,7S,7aS)-2-(p-tolyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
C16H15NO2
2-(3,5-Dichlorophenyl)-3a,4,7,7a-tetrahydro-4,7-methano-1H-isoindole-1,3(2H)-dione chemical structure, C15H11Cl2NO2, CAS 40506-09-0
2-(3,5-Dichlorophenyl)-3a,4,7,7a-tetrahydro-4,7-methano-1H-isoindole-1,3(2H)-dione
CAS 40506-09-0C15H11Cl2NO2
3-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid chemical structure, C16H13NO4, CAS 117958-24-4
3-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid
CAS 117958-24-4C16H13NO4
2-(4-Methoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione chemical structure, C16H15NO3, CAS 19077-64-6
2-(4-Methoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
CAS 19077-64-6C16H15NO3
4-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl acetate chemical structure, C17H15NO4, CAS 19388-23-9
4-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl acetate
CAS 19388-23-9C17H15NO4
3-(3,5-Dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)phenyl acetate chemical structure, C17H15NO4, CAS 5156-32-1
3-(3,5-Dioxo-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)phenyl acetate
CAS 5156-32-1C17H15NO4
5-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzene-1,3-dicarboxylic acid chemical structure, C17H13NO6, CAS 329736-49-4
5-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzene-1,3-dicarboxylic acid
CAS 329736-49-4C17H13NO6
N-[4-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]acetamide chemical structure, C17H16N2O3, CAS 349103-08-8
N-[4-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]acetamide
CAS 349103-08-8C17H16N2O3
2-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid chemical structure, C16H13NO4, CAS 298682-50-5
2-(1,3-Dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid
CAS 298682-50-5C16H13NO4