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Murcko scaffold

1,3-Indandione scaffold

138 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
11
Chemicals
138
With full pages
24
Scaffold SMILES

O=C1CC(=O)c2ccccc21

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 1,3-Indandione page
Murcko scaffold O=C1CC(=O)c2ccccc21

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 49 to 96 of 138 chemicals

2,2-Dichloroindene-1,3-dione chemical structure, C9H4Cl2O2, CAS 32974-80-4
2,2-Dichloroindene-1,3-dione
CAS 32974-80-4C9H4Cl2O2
2-Chloro-2-nitro-1H-indene-1,3(2H)-dione chemical structure, C9H4ClNO4, CAS 90415-25-1
2-Chloro-2-nitro-1H-indene-1,3(2H)-dione
CAS 90415-25-1C9H4ClNO4
4,5,6,7-Tetrachloro-2,3-dihydro-1H-indene-1,3-dione chemical structure, C9H2Cl4O2, CAS 30675-13-9
4,5,6,7-Tetrachloro-2,3-dihydro-1H-indene-1,3-dione
CAS 30675-13-9C9H2Cl4O2
2-Acetyl-4-nitro-1H-indene-1,3(2H)-dione chemical structure, C11H7NO5, CAS 25125-04-6
2-Acetyl-4-nitro-1H-indene-1,3(2H)-dione
CAS 25125-04-6C11H7NO5
4-Nitro-1H-indene-1,3(2H)-dione chemical structure, C9H5NO4, CAS 4535-07-3
4-Nitro-1H-indene-1,3(2H)-dione
CAS 4535-07-3C9H5NO4
5,6-Dichloro-1H-indene-1,3(2H)-dione chemical structure, C9H4Cl2O2, CAS 93296-41-4
5,6-Dichloro-1H-indene-1,3(2H)-dione
CAS 93296-41-4C9H4Cl2O2
Ethyl 2-cyano-2-(2-hydroxy-1,3-dioxoinden-2-yl)acetate chemical structure, C14H11NO5, CAS 30511-20-7
Ethyl 2-cyano-2-(2-hydroxy-1,3-dioxoinden-2-yl)acetate
CAS 30511-20-7C14H11NO5
Acetamide, 2-chloro-N-(1,3-dioxo-2-ethyl-2-indanyl)-N-methyl- chemical structure, C14H14ClNO3, CAS 59209-57-3
Acetamide, 2-chloro-N-(1,3-dioxo-2-ethyl-2-indanyl)-N-methyl-
CAS 59209-57-3C14H14ClNO3
1,3-Indandione, 2-ethyl-2-(propylamino)- chemical structure, C14H17NO2, CAS 59209-60-8
1,3-Indandione, 2-ethyl-2-(propylamino)-
CAS 59209-60-8C14H17NO2
Acetamide, 2-(diethylamino)-N-(1,3-dioxo-2-ethyl-2-indanyl)-N-methyl- chemical structure, C18H24N2O3, CAS 59209-61-9
Acetamide, 2-(diethylamino)-N-(1,3-dioxo-2-ethyl-2-indanyl)-N-methyl-
CAS 59209-61-9C18H24N2O3
Methyl 1,3-dioxo-2,3-dihydro-1H-indene-2-carboxylate chemical structure, C11H8O4, CAS 1785-84-8
Methyl 1,3-dioxo-2,3-dihydro-1H-indene-2-carboxylate
CAS 1785-84-8C11H8O4
1H-Indene-1,3(2H)-dione, 2-(1-methylethyl)- chemical structure, C12H12O2, CAS 134361-57-2
1H-Indene-1,3(2H)-dione, 2-(1-methylethyl)-
CAS 134361-57-2C12H12O2
2-(2,2-Dimethylpropanimidoyl)indene-1,3-dione chemical structure, C14H15NO2, CAS 634155-04-7
2-(2,2-Dimethylpropanimidoyl)indene-1,3-dione
CAS 634155-04-7C14H15NO2
2,2-Di(prop-2-yn-1-yl)-1H-indene-1,3(2H)-dione chemical structure, C15H10O2, CAS 24241-98-3
2,2-Di(prop-2-yn-1-yl)-1H-indene-1,3(2H)-dione
CAS 24241-98-3C15H10O2
1H-Indene-2-carboxylic acid, 2,3-dihydro-1,3-dioxo- chemical structure, C10H6O4, CAS 7033-76-3
1H-Indene-2-carboxylic acid, 2,3-dihydro-1,3-dioxo-
CAS 7033-76-3C10H6O4
1,3-Dioxo-2,3-dihydro-1H-indene-5-carboxylic acid chemical structure, C10H6O4, CAS 40462-10-0
1,3-Dioxo-2,3-dihydro-1H-indene-5-carboxylic acid
CAS 40462-10-0C10H6O4
2-Indancarboxylic aicd, 2-(amidinothio)-1,3-dioxo-, ethyl ester, hydrochloride chemical structure, C13H13ClN2O4S, CAS 2988-58-1
2-Indancarboxylic aicd, 2-(amidinothio)-1,3-dioxo-, ethyl ester, hydrochloride
CAS 2988-58-1C13H13ClN2O4S
2-Ethanehydrazonoylindene-1,3-dione chemical structure, C11H10N2O2, CAS 39560-80-0
2-Ethanehydrazonoylindene-1,3-dione
CAS 39560-80-0C11H10N2O2
2-(3-Methylbutanehydrazonoyl)indene-1,3-dione chemical structure, C14H16N2O2, CAS 1025813-41-5
2-(3-Methylbutanehydrazonoyl)indene-1,3-dione
CAS 1025813-41-5C14H16N2O2
2-Hydroxy-1H-indene-1,3(2H)-dione chemical structure, C9H6O3, CAS 26976-58-9
2-Hydroxy-1H-indene-1,3(2H)-dione
CAS 26976-58-9C9H6O3
5-Bromo-2,3-dihydro-1H-indene-1,3-dione chemical structure, C9H5BrO2, CAS 27611-39-8
5-Bromo-2,3-dihydro-1H-indene-1,3-dione
CAS 27611-39-8C9H5BrO2
1H-Indene-1,3(2H)-dione, 2,2-diethoxy- chemical structure, C13H14O4, CAS 20847-51-2
1H-Indene-1,3(2H)-dione, 2,2-diethoxy-
CAS 20847-51-2C13H14O4
5-Methylthioninhydrin chemical structure, C10H8O4S, CAS 138485-86-6
5-Methylthioninhydrin
CAS 138485-86-6C10H8O4S
1H-Indene-1,3(2H)-dione, 5-bromo-2,2-dimethoxy- chemical structure, C11H9BrO4, CAS 160775-51-9
1H-Indene-1,3(2H)-dione, 5-bromo-2,2-dimethoxy-
CAS 160775-51-9C11H9BrO4