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Murcko scaffold

Ring system with 4 rings and 27 atoms

19 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
27
Chemicals
19
With full pages
1
Scaffold SMILES

O=c1[nH]c(=O)c2c(nc(N3CCOCC3)n2CCCOc2ccccc2)[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)n2CCCOc2ccccc2)[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 19 of 19 chemicals

7-(2-Hydroxy-3-phenoxypropyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C19H23N5O5, CAS 102838-05-1
7-(2-Hydroxy-3-phenoxypropyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 102838-05-1C19H23N5O5
7-[3-(4-Chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-morpholin-4-ylpurine-2,6-dione chemical structure, C19H22ClN5O5, CAS 317840-86-1
7-[3-(4-Chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-morpholin-4-ylpurine-2,6-dione
CAS 317840-86-1C19H22ClN5O5
7-[2-Hydroxy-3-(4-nitrophenoxy)propyl]-3-methyl-8-morpholin-4-ylpurine-2,6-dione chemical structure, C19H22N6O7, CAS 304876-22-0
7-[2-Hydroxy-3-(4-nitrophenoxy)propyl]-3-methyl-8-morpholin-4-ylpurine-2,6-dione
CAS 304876-22-0C19H22N6O7
7-[2-Hydroxy-3-(4-iodophenoxy)propyl]-3-methyl-8-(morpholin-4-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione chemical structure, C19H22IN5O5, CAS 313665-39-3
7-[2-Hydroxy-3-(4-iodophenoxy)propyl]-3-methyl-8-(morpholin-4-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
CAS 313665-39-3C19H22IN5O5
7-(2-Hydroxy-3-(o-tolyloxy)propyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C20H25N5O5, CAS 332103-46-5
7-(2-Hydroxy-3-(o-tolyloxy)propyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 332103-46-5C20H25N5O5
7-(3-(4-Chlorophenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C20H24ClN5O5, CAS 333305-40-1
7-(3-(4-Chlorophenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 333305-40-1C20H24ClN5O5
7-(2-Hydroxy-3-(4-methoxyphenoxy)propyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C21H27N5O6, CAS 333755-41-2
7-(2-Hydroxy-3-(4-methoxyphenoxy)propyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 333755-41-2C21H27N5O6
7-(2-Hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C20H25N5O5, CAS 848219-37-4
7-(2-Hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 848219-37-4C20H25N5O5
7-(3-(2,4-Dichlorophenoxy)-2-hydroxypropyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C19H21Cl2N5O5, CAS 313665-44-0
7-(3-(2,4-Dichlorophenoxy)-2-hydroxypropyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 313665-44-0C19H21Cl2N5O5
3-Methyl-8-morpholino-7-(3-phenoxypropyl)-1H-purine-2,6(3H,7H)-dione chemical structure, C19H23N5O4, CAS 876892-49-8
3-Methyl-8-morpholino-7-(3-phenoxypropyl)-1H-purine-2,6(3H,7H)-dione
CAS 876892-49-8C19H23N5O4
7-(3-(3,4-Dimethylphenoxy)-2-hydroxypropyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C21H27N5O5, CAS 879071-60-0
7-(3-(3,4-Dimethylphenoxy)-2-hydroxypropyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 879071-60-0C21H27N5O5
7-(3-(3,4-Dimethylphenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C22H29N5O5, CAS 879072-40-9
7-(3-(3,4-Dimethylphenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 879072-40-9C22H29N5O5
7-(3-(3-Ethylphenoxy)-2-hydroxypropyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C21H27N5O5, CAS 941937-09-3
7-(3-(3-Ethylphenoxy)-2-hydroxypropyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 941937-09-3C21H27N5O5
7-(2-Hydroxy-3-(2-isopropyl-5-methylphenoxy)propyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C23H31N5O5, CAS 941965-31-7
7-(2-Hydroxy-3-(2-isopropyl-5-methylphenoxy)propyl)-3-methyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 941965-31-7C23H31N5O5
7-(3-(2,4-Dichlorophenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C20H23Cl2N5O5, CAS 923687-80-3
7-(3-(2,4-Dichlorophenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 923687-80-3C20H23Cl2N5O5
7-(3-(3-Ethylphenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C22H29N5O5, CAS 941936-87-4
7-(3-(3-Ethylphenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 941936-87-4C22H29N5O5
7-(2-Hydroxy-3-(2-isopropyl-5-methylphenoxy)propyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C24H33N5O5, CAS 923210-98-4
7-(2-Hydroxy-3-(2-isopropyl-5-methylphenoxy)propyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 923210-98-4C24H33N5O5
1,3-Dimethyl-8-morpholino-7-(3-phenoxypropyl)-1H-purine-2,6(3H,7H)-dione chemical structure, C20H25N5O4, CAS 100000-65-5
1,3-Dimethyl-8-morpholino-7-(3-phenoxypropyl)-1H-purine-2,6(3H,7H)-dione
CAS 100000-65-5C20H25N5O4
7-(3-(2-Chlorophenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione chemical structure, C20H24ClN5O5, CAS 1105244-12-9
7-(3-(2-Chlorophenoxy)-2-hydroxypropyl)-1,3-dimethyl-8-morpholino-1H-purine-2,6(3H,7H)-dione
CAS 1105244-12-9C20H24ClN5O5