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Murcko scaffold

Ring system with 4 rings and 25 atoms

35 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
25
Chemicals
35
With full pages
6
Scaffold SMILES

O=c1[nH]c(=O)c2c(nc(CN3CCOCC3)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(CN3CCOCC3)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 35 of 35 chemicals

7-Benzyl-1,3-dimethyl-8-morpholin-4-ylmethyl-3,7-dihydro-purine-2,6-dione chemical structure, C19H23N5O3, CAS 586992-95-2
7-Benzyl-1,3-dimethyl-8-morpholin-4-ylmethyl-3,7-dihydro-purine-2,6-dione
CAS 586992-95-2C19H23N5O3
1,3-Dimethyl-7-(4-methyl-benzyl)-8-morpholin-4-ylmethyl-3,7-dihydro-purine-2,6-dione chemical structure, C20H25N5O3, CAS 573934-34-6
1,3-Dimethyl-7-(4-methyl-benzyl)-8-morpholin-4-ylmethyl-3,7-dihydro-purine-2,6-dione
CAS 573934-34-6C20H25N5O3
7-(4-Chlorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione chemical structure, C19H22ClN5O3, CAS 585552-29-0
7-(4-Chlorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
CAS 585552-29-0C19H22ClN5O3
7-(4-Fluorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione chemical structure, C19H22FN5O3, CAS 577964-39-7
7-(4-Fluorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
CAS 577964-39-7C19H22FN5O3
7-(2-Chlorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione chemical structure, C19H22ClN5O3, CAS 578745-29-6
7-(2-Chlorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
CAS 578745-29-6C19H22ClN5O3
7-(2-Chloro-6-fluorobenzyl)-1,3-dimethyl-8-(morpholinomethyl)-1H-purine-2,6(3H,7H)-dione chemical structure, C19H21ClFN5O3, CAS 797028-27-4
7-(2-Chloro-6-fluorobenzyl)-1,3-dimethyl-8-(morpholinomethyl)-1H-purine-2,6(3H,7H)-dione
CAS 797028-27-4C19H21ClFN5O3
7-(3,4-Dichlorobenzyl)-8-((2,6-dimethylmorpholino)methyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione chemical structure, C21H25Cl2N5O3, CAS 838870-75-0
7-(3,4-Dichlorobenzyl)-8-((2,6-dimethylmorpholino)methyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
CAS 838870-75-0C21H25Cl2N5O3
7-(3-Chlorobenzyl)-3-methyl-8-(morpholinomethyl)-1H-purine-2,6(3H,7H)-dione chemical structure, C18H20ClN5O3, CAS 868143-64-0
7-(3-Chlorobenzyl)-3-methyl-8-(morpholinomethyl)-1H-purine-2,6(3H,7H)-dione
CAS 868143-64-0C18H20ClN5O3
7-(2-Fluorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione chemical structure, C19H22FN5O3, CAS 838891-36-4
7-(2-Fluorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
CAS 838891-36-4C19H22FN5O3
7-(3-Chlorobenzyl)-8-((2,6-dimethylmorpholino)methyl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C20H24ClN5O3, CAS 838899-57-3
7-(3-Chlorobenzyl)-8-((2,6-dimethylmorpholino)methyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
CAS 838899-57-3C20H24ClN5O3
7-[(4-Bromophenyl)methyl]-8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethylpurine-2,6-dione chemical structure, C21H26BrN5O3, CAS 838900-34-8
7-[(4-Bromophenyl)methyl]-8-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-dimethylpurine-2,6-dione
CAS 838900-34-8C21H26BrN5O3
7-[(2,5-Dimethylphenyl)methyl]-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione chemical structure, C21H27N5O3, CAS 838900-46-2
7-[(2,5-Dimethylphenyl)methyl]-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione
CAS 838900-46-2C21H27N5O3
3-Methyl-7-(4-methylbenzyl)-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione chemical structure, C19H23N5O3, CAS 847407-91-4
3-Methyl-7-(4-methylbenzyl)-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
CAS 847407-91-4C19H23N5O3
8-[(2,6-Dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-7-[(4-methylphenyl)methyl]purine-2,6-dione chemical structure, C22H29N5O3, CAS 851939-21-4
8-[(2,6-Dimethylmorpholin-4-yl)methyl]-1,3-dimethyl-7-[(4-methylphenyl)methyl]purine-2,6-dione
CAS 851939-21-4C22H29N5O3
1,3-Dimethyl-7-[(3-methylphenyl)methyl]-8-(morpholin-4-ylmethyl)purine-2,6-dione chemical structure, C20H25N5O3, CAS 851938-76-6
1,3-Dimethyl-7-[(3-methylphenyl)methyl]-8-(morpholin-4-ylmethyl)purine-2,6-dione
CAS 851938-76-6C20H25N5O3
8-[(2,6-Dimethylmorpholin-4-yl)methyl]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione chemical structure, C21H26FN5O3, CAS 851937-94-5
8-[(2,6-Dimethylmorpholin-4-yl)methyl]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
CAS 851937-94-5C21H26FN5O3
7-[(3,4-Dichlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione chemical structure, C19H21Cl2N5O3, CAS 872628-00-7
7-[(3,4-Dichlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione
CAS 872628-00-7C19H21Cl2N5O3
7-[(2,6-Dichlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione chemical structure, C19H21Cl2N5O3, CAS 872627-99-1
7-[(2,6-Dichlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione
CAS 872627-99-1C19H21Cl2N5O3
7-[(2,4-Dichlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione chemical structure, C19H21Cl2N5O3, CAS 851940-25-5
7-[(2,4-Dichlorophenyl)methyl]-1,3-dimethyl-8-(morpholin-4-ylmethyl)purine-2,6-dione
CAS 851940-25-5C19H21Cl2N5O3
7-(2,6-Dichlorobenzyl)-8-((2,6-dimethylmorpholino)methyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione chemical structure, C21H25Cl2N5O3, CAS 868146-65-0
7-(2,6-Dichlorobenzyl)-8-((2,6-dimethylmorpholino)methyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
CAS 868146-65-0C21H25Cl2N5O3
1,3-Dimethyl-7-[(2-methylphenyl)methyl]-8-(morpholin-4-ylmethyl)purine-2,6-dione chemical structure, C20H25N5O3, CAS 851938-18-6
1,3-Dimethyl-7-[(2-methylphenyl)methyl]-8-(morpholin-4-ylmethyl)purine-2,6-dione
CAS 851938-18-6C20H25N5O3
7-[(2,6-Dichlorophenyl)methyl]-3-methyl-8-(morpholin-4-ylmethyl)purine-2,6-dione chemical structure, C18H19Cl2N5O3, CAS 876898-91-8
7-[(2,6-Dichlorophenyl)methyl]-3-methyl-8-(morpholin-4-ylmethyl)purine-2,6-dione
CAS 876898-91-8C18H19Cl2N5O3
7-[(4-Chlorophenyl)methyl]-3-methyl-8-(morpholin-4-ylmethyl)purine-2,6-dione chemical structure, C18H20ClN5O3, CAS 847408-39-3
7-[(4-Chlorophenyl)methyl]-3-methyl-8-(morpholin-4-ylmethyl)purine-2,6-dione
CAS 847408-39-3C18H20ClN5O3
7-(3-Chlorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione chemical structure, C19H22ClN5O3, CAS 851940-02-8
7-(3-Chlorobenzyl)-1,3-dimethyl-8-(morpholin-4-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione
CAS 851940-02-8C19H22ClN5O3