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Murcko scaffold

Ring system with 4 rings and 30 atoms

16 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
30
Chemicals
16
With full pages
3
Scaffold SMILES

O=c1[nH]c(=O)c2c(nc(NN=Cc3ccccc3)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(NN=Cc3ccccc3)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 16 of 16 chemicals

7-[2-Hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]purine-2,6-dione chemical structure, C25H28N6O4, CAS 376374-25-3
7-[2-Hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]purine-2,6-dione
CAS 376374-25-3C25H28N6O4
7-[2-Hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]purine-2,6-dione chemical structure, C24H26N6O4, CAS 372153-89-4
7-[2-Hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]purine-2,6-dione
CAS 372153-89-4C24H26N6O4
7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-3-methyl-8-[(2E)-2-[(3-nitrophenyl)methylidene]hydrazinyl]purine-2,6-dione chemical structure, C24H25N7O6, CAS 331271-25-1
7-[3-(4-Ethylphenoxy)-2-hydroxypropyl]-3-methyl-8-[(2E)-2-[(3-nitrophenyl)methylidene]hydrazinyl]purine-2,6-dione
CAS 331271-25-1C24H25N7O6
(E)-8-(2-Benzylidenehydrazinyl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C22H22N6O4, CAS 331839-88-4
(E)-8-(2-Benzylidenehydrazinyl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
CAS 331839-88-4C22H22N6O4
(E)-8-(2-(4-Chlorobenzylidene)hydrazinyl)-7-(2-hydroxy-3-(o-tolyloxy)propyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione chemical structure, C24H25ClN6O4, CAS 374911-16-7
(E)-8-(2-(4-Chlorobenzylidene)hydrazinyl)-7-(2-hydroxy-3-(o-tolyloxy)propyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
CAS 374911-16-7C24H25ClN6O4
(E)-7-(2-Hydroxy-3-phenoxypropyl)-8-(2-(4-methoxybenzylidene)hydrazinyl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C23H24N6O5, CAS 300700-54-3
(E)-7-(2-Hydroxy-3-phenoxypropyl)-8-(2-(4-methoxybenzylidene)hydrazinyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
CAS 300700-54-3C23H24N6O5
(E)-8-(2-(4-(Dimethylamino)benzylidene)hydrazinyl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C24H27N7O4, CAS 374910-54-0
(E)-8-(2-(4-(Dimethylamino)benzylidene)hydrazinyl)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
CAS 374910-54-0C24H27N7O4
(E)-7-(2-Hydroxy-3-(o-tolyloxy)propyl)-8-(2-(1-(4-methoxyphenyl)ethylidene)hydrazinyl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C25H28N6O5, CAS 372087-57-5
(E)-7-(2-Hydroxy-3-(o-tolyloxy)propyl)-8-(2-(1-(4-methoxyphenyl)ethylidene)hydrazinyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
CAS 372087-57-5C25H28N6O5
(E)-7-(2-Hydroxy-3-(4-methoxyphenoxy)propyl)-3-methyl-8-(2-(1-phenylethylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione chemical structure, C24H26N6O5, CAS 300586-72-5
(E)-7-(2-Hydroxy-3-(4-methoxyphenoxy)propyl)-3-methyl-8-(2-(1-phenylethylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione
CAS 300586-72-5C24H26N6O5
(E)-7-(2-Hydroxy-3-(o-tolyloxy)propyl)-1,3-dimethyl-8-(2-(3-nitrobenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione chemical structure, C24H25N7O6, CAS 375842-59-4
(E)-7-(2-Hydroxy-3-(o-tolyloxy)propyl)-1,3-dimethyl-8-(2-(3-nitrobenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione
CAS 375842-59-4C24H25N7O6
(E)-8-(2-Benzylidenehydrazinyl)-7-(2-hydroxy-3-(4-methoxyphenoxy)propyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione chemical structure, C24H26N6O5, CAS 683790-62-7
(E)-8-(2-Benzylidenehydrazinyl)-7-(2-hydroxy-3-(4-methoxyphenoxy)propyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
CAS 683790-62-7C24H26N6O5
(E)-7-(2-Hydroxy-3-phenoxypropyl)-8-(2-(1-(2-hydroxyphenyl)ethylidene)hydrazinyl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C23H24N6O5, CAS 331839-89-5
(E)-7-(2-Hydroxy-3-phenoxypropyl)-8-(2-(1-(2-hydroxyphenyl)ethylidene)hydrazinyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
CAS 331839-89-5C23H24N6O5
(E)-7-(2-Hydroxy-3-(o-tolyloxy)propyl)-8-(2-(2-hydroxybenzylidene)hydrazinyl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C23H24N6O5, CAS 372153-63-4
(E)-7-(2-Hydroxy-3-(o-tolyloxy)propyl)-8-(2-(2-hydroxybenzylidene)hydrazinyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
CAS 372153-63-4C23H24N6O5
(E)-7-(2-Hydroxy-3-(4-methoxyphenoxy)propyl)-8-(2-(4-hydroxybenzylidene)hydrazinyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione chemical structure, C24H26N6O6, CAS 682776-21-2
(E)-7-(2-Hydroxy-3-(4-methoxyphenoxy)propyl)-8-(2-(4-hydroxybenzylidene)hydrazinyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
CAS 682776-21-2C24H26N6O6
8-(2-(2,4-Dihydroxybenzylidene)hydrazinyl)-7-(3-(3-ethylphenoxy)-2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C24H26N6O6, CAS 899724-68-6
8-(2-(2,4-Dihydroxybenzylidene)hydrazinyl)-7-(3-(3-ethylphenoxy)-2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
CAS 899724-68-6C24H26N6O6
8-{2-[(2,4-Dihydroxyphenyl)methylidene]hydrazin-1-yl}-7-[3-(3-ethylphenoxy)-2-hydroxypropyl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione chemical structure, C24H26N6O6
8-{2-[(2,4-Dihydroxyphenyl)methylidene]hydrazin-1-yl}-7-[3-(3-ethylphenoxy)-2-hydroxypropyl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
C24H26N6O6