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Murcko scaffold

Ring system with 3 rings and 16 atoms

230 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 16
Chemicals: 230
With full pages: 5

Scaffold SMILES

O=c1[nH]c(=O)c2[nH]c(-n3cccn3)nc2[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)c2[nH]c(-n3cccn3)nc2[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 48 of 230 chemicals

8-(3,5-Dimethylpyrazol-1-yl)-1,3,7-trimethylpurine-2,6-dione chemical structure, C13H16N6O2, CAS 108950-58-9

8-(3,5-Dimethylpyrazol-1-yl)-1,3,7-trimethylpurine-2,6-dione

CAS 108950-58-9C₁₃H₁₆N₆O₂

8-(3,5-Dimethyl-pyrazol-1-yl)-7-isopropyl-3-methyl-3,7-dihydro-purine-2,6-dione chemical structure, C14H18N6O2, CAS 189126-87-2

8-(3,5-Dimethyl-pyrazol-1-yl)-7-isopropyl-3-methyl-3,7-dihydro-purine-2,6-dione

CAS 189126-87-2C₁₄H₁₈N₆O₂

8-(3,5-Dimethyl-pyrazol-1-yl)-7-isobutyl-3-methyl-3,7-dihydro-purine-2,6-dione chemical structure, C15H20N6O2, CAS 302785-52-0

8-(3,5-Dimethyl-pyrazol-1-yl)-7-isobutyl-3-methyl-3,7-dihydro-purine-2,6-dione

CAS 302785-52-0C₁₅H₂₀N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione chemical structure, C12H14N6O2, CAS 145351-63-9

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione

CAS 145351-63-9C₁₂H₁₄N₆O₂

8-(3,5-Dimethylpyrazol-1-yl)-3,7-dimethyl-1-prop-2-enylpurine-2,6-dione chemical structure, C15H18N6O2, CAS 957422-51-4

8-(3,5-Dimethylpyrazol-1-yl)-3,7-dimethyl-1-prop-2-enylpurine-2,6-dione

CAS 957422-51-4C₁₅H₁₈N₆O₂

8-(3,5-Dimethylpyrazolyl)-7-ethyl-3-methyl-1,3,7-trihydropurine-2,6-dione chemical structure, C13H16N6O2, CAS 189126-85-0

8-(3,5-Dimethylpyrazolyl)-7-ethyl-3-methyl-1,3,7-trihydropurine-2,6-dione

CAS 189126-85-0C₁₃H₁₆N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-methyl-7-propyl-1H-purine-2,6(3H,7H)-dione chemical structure, C14H18N6O2, CAS 1014072-71-9

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-methyl-7-propyl-1H-purine-2,6(3H,7H)-dione

CAS 1014072-71-9C₁₄H₁₈N₆O₂

8-(3,5-Dimethylpyrazolyl)-7-butyl-3-methyl-1,3,7-trihydropurine-2,6-dione chemical structure, C15H20N6O2, CAS 1014072-77-5

8-(3,5-Dimethylpyrazolyl)-7-butyl-3-methyl-1,3,7-trihydropurine-2,6-dione

CAS 1014072-77-5C₁₅H₂₀N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C16H22N6O2, CAS 1014072-83-3

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione

CAS 1014072-83-3C₁₆H₂₂N₆O₂

7-Allyl-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C14H16N6O2, CAS 1014072-84-4

7-Allyl-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3-methyl-1H-purine-2,6(3H,7H)-dione

CAS 1014072-84-4C₁₄H₁₆N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-methyl-7-(2-methylallyl)-1H-purine-2,6(3H,7H)-dione chemical structure, C15H18N6O2, CAS 1014072-87-7

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-methyl-7-(2-methylallyl)-1H-purine-2,6(3H,7H)-dione

CAS 1014072-87-7C₁₅H₁₈N₆O₂

7-[(2E)-But-2-en-1-yl]-8-(3,5-dimethyl-1H-pyrazol-1-yl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one chemical structure, C15H18N6O2, CAS 1014072-91-3

7-[(2E)-But-2-en-1-yl]-8-(3,5-dimethyl-1H-pyrazol-1-yl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one

CAS 1014072-91-3C₁₅H₁₈N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-7-(2-ethoxyethyl)-3-methyl-1H-purine-2,6(3H,7H)-dione chemical structure, C15H20N6O3, CAS 1014073-11-0

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-7-(2-ethoxyethyl)-3-methyl-1H-purine-2,6(3H,7H)-dione

CAS 1014073-11-0C₁₅H₂₀N₆O₃

8-(3,5-Dimethylpyrazolyl)-7-ethyl-1,3-dimethyl-1,3,7-trihydropurine-2,6-dione chemical structure, C14H18N6O2, CAS 189689-48-3

8-(3,5-Dimethylpyrazolyl)-7-ethyl-1,3-dimethyl-1,3,7-trihydropurine-2,6-dione

CAS 189689-48-3C₁₄H₁₈N₆O₂

8-(3,5-Dimethylpyrazolyl)-7-butyl-1,3-dimethyl-1,3,7-trihydropurine-2,6-dione chemical structure, C16H22N6O2, CAS 189689-51-8

8-(3,5-Dimethylpyrazolyl)-7-butyl-1,3-dimethyl-1,3,7-trihydropurine-2,6-dione

CAS 189689-51-8C₁₆H₂₂N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1,3-dimethyl-7-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione chemical structure, C17H24N6O2, CAS 1014073-14-3

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1,3-dimethyl-7-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

CAS 1014073-14-3C₁₇H₂₄N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione chemical structure, C16H20N6O2, CAS 1014073-34-7

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

CAS 1014073-34-7C₁₆H₂₀N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1-ethyl-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione chemical structure, C14H18N6O2, CAS 1014073-88-1

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1-ethyl-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione

CAS 1014073-88-1C₁₄H₁₈N₆O₂

8-(3,5-Dimethylpyrazolyl)-1-butyl-3,7-dimethyl-1,3,7-trihydropurine-2,6-dione chemical structure, C16H22N6O2, CAS 1014074-11-3

8-(3,5-Dimethylpyrazolyl)-1-butyl-3,7-dimethyl-1,3,7-trihydropurine-2,6-dione

CAS 1014074-11-3C₁₆H₂₂N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1-isobutyl-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione chemical structure, C16H22N6O2, CAS 1014074-19-1

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1-isobutyl-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione

CAS 1014074-19-1C₁₆H₂₂N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3,7-dimethyl-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione chemical structure, C17H24N6O2, CAS 1014074-36-2

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3,7-dimethyl-1-(3-methylbutyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

CAS 1014074-36-2C₁₇H₂₄N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3,7-dimethyl-1-(2-methylprop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione chemical structure, C16H20N6O2, CAS 1014074-41-9

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-3,7-dimethyl-1-(2-methylprop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione

CAS 1014074-41-9C₁₆H₂₀N₆O₂

1-[(E)-But-2-enyl]-8-(3,5-dimethylpyrazol-1-yl)-3,7-dimethylpurine-2,6-dione chemical structure, C16H20N6O2, CAS 1014074-46-4

1-[(E)-But-2-enyl]-8-(3,5-dimethylpyrazol-1-yl)-3,7-dimethylpurine-2,6-dione

CAS 1014074-46-4C₁₆H₂₀N₆O₂

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1-(2-methoxyethyl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione chemical structure, C15H20N6O3, CAS 1014092-10-4

8-(3,5-Dimethyl-1H-pyrazol-1-yl)-1-(2-methoxyethyl)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione

CAS 1014092-10-4C₁₅H₂₀N₆O₃