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Murcko scaffold

Ring system with 4 rings and 24 atoms

15 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
24
Chemicals
15
With full pages
5
Scaffold SMILES

O=c1[nH]c(=O)c2c(nc(N3CCOCC3)n2Cc2ccccc2)[nH]1

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=c1[nH]c(=O)c2c(nc(N3CCOCC3)n2Cc2ccccc2)[nH]1

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 15 of 15 chemicals

8-(2,6-Dimethyl-morpholin-4-yl)-7-(2-fluoro-benzyl)-3-methyl-3,7-dihydro-purine-2,6-dione chemical structure, C19H22FN5O3, CAS 672934-94-0
8-(2,6-Dimethyl-morpholin-4-yl)-7-(2-fluoro-benzyl)-3-methyl-3,7-dihydro-purine-2,6-dione
CAS 672934-94-0C19H22FN5O3
7-Benzyl-3-methyl-8-morpholin-4-yl-3,7-dihydro-purine-2,6-dione chemical structure, C17H19N5O3, CAS 106306-86-9
7-Benzyl-3-methyl-8-morpholin-4-yl-3,7-dihydro-purine-2,6-dione
CAS 106306-86-9C17H19N5O3
7-Benzyl-1,3-dimethyl-8-morpholin-4-yl-3,7-dihydro-purine-2,6-dione chemical structure, C18H21N5O3, CAS 368434-78-0
7-Benzyl-1,3-dimethyl-8-morpholin-4-yl-3,7-dihydro-purine-2,6-dione
CAS 368434-78-0C18H21N5O3
1,3-Dimethyl-7-(3-methylbenzyl)-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C19H23N5O3, CAS 361174-71-2
1,3-Dimethyl-7-(3-methylbenzyl)-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 361174-71-2C19H23N5O3
7-(2-Chloro-benzyl)-1,3-dimethyl-8-morpholin-4-yl-3,7-dihydro-purine-2,6-dione chemical structure, C18H20ClN5O3, CAS 317844-17-0
7-(2-Chloro-benzyl)-1,3-dimethyl-8-morpholin-4-yl-3,7-dihydro-purine-2,6-dione
CAS 317844-17-0C18H20ClN5O3
7-(2-Chlorobenzyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C17H18ClN5O3, CAS 330202-47-6
7-(2-Chlorobenzyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 330202-47-6C17H18ClN5O3
7-(4-Fluorobenzyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C18H20FN5O3, CAS 364616-66-0
7-(4-Fluorobenzyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 364616-66-0C18H20FN5O3
7-(4-Fluorobenzyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C17H18FN5O3, CAS 442555-96-6
7-(4-Fluorobenzyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 442555-96-6C17H18FN5O3
7-(4-Chlorobenzyl)-3-methyl-8-(4-morpholinyl)-3,7-dihydro-1H-purine-2,6-dione chemical structure, C17H18ClN5O3, CAS 305864-40-8
7-(4-Chlorobenzyl)-3-methyl-8-(4-morpholinyl)-3,7-dihydro-1H-purine-2,6-dione
CAS 305864-40-8C17H18ClN5O3
7-[(3-Bromophenyl)methyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione chemical structure, C18H20BrN5O3, CAS 304881-02-5
7-[(3-Bromophenyl)methyl]-1,3-dimethyl-8-morpholin-4-ylpurine-2,6-dione
CAS 304881-02-5C18H20BrN5O3
7-[(4-Chlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione chemical structure, C18H20ClN5O3, CAS 326919-18-0
7-[(4-Chlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
CAS 326919-18-0C18H20ClN5O3
1,3-Dimethyl-7-(4-ME-benzyl)-8-(4-morpholinyl)-3,7-dihydro-1H-purine-2,6-dione chemical structure, C19H23N5O3, CAS 332904-79-7
1,3-Dimethyl-7-(4-ME-benzyl)-8-(4-morpholinyl)-3,7-dihydro-1H-purine-2,6-dione
CAS 332904-79-7C19H23N5O3
7-(2-Fluoro-benzyl)-3-methyl-8-morpholin-4-yl-3,7-dihydro-purine-2,6-dione chemical structure, C17H18FN5O3, CAS 674359-72-9
7-(2-Fluoro-benzyl)-3-methyl-8-morpholin-4-yl-3,7-dihydro-purine-2,6-dione
CAS 674359-72-9C17H18FN5O3
Ethyl (7-benzyl-3-methyl-8-morpholin-4-yl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetate chemical structure, C21H25N5O5, CAS 353255-01-3
Ethyl (7-benzyl-3-methyl-8-morpholin-4-yl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl)acetate
CAS 353255-01-3C21H25N5O5
1,3-Dimethyl-8-morpholino-7-(1-phenylethyl)-1H-purine-2,6(3H,7H)-dione chemical structure, C19H23N5O3, CAS 1105244-60-7
1,3-Dimethyl-8-morpholino-7-(1-phenylethyl)-1H-purine-2,6(3H,7H)-dione
CAS 1105244-60-7C19H23N5O3