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Murcko scaffold

Ring system with 2 rings and 13 atoms

28 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
13
Chemicals
28
With full pages
3
Scaffold SMILES

O=C1NCCC(c2ccccc2)N1

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=C1NCCC(c2ccccc2)N1

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 28 of 28 chemicals

Ethyl 6-(3-fluorophenyl)-4-hydroxy-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate chemical structure, C14H14F4N2O4, CAS 474258-00-9
Ethyl 6-(3-fluorophenyl)-4-hydroxy-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
CAS 474258-00-9C14H14F4N2O4
Ethyl 6-hydroxy-1-methyl-2-oxo-6-(trifluoromethyl)-4-(3,4,5-trimethoxyphenyl)hexahydro-5-pyrimidinecarboxylate chemical structure, C18H23F3N2O7, CAS 459155-79-4
Ethyl 6-hydroxy-1-methyl-2-oxo-6-(trifluoromethyl)-4-(3,4,5-trimethoxyphenyl)hexahydro-5-pyrimidinecarboxylate
CAS 459155-79-4C18H23F3N2O7
Ethyl 6-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate chemical structure, C14H13Cl2F3N2O4, CAS 376351-43-8
Ethyl 6-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
CAS 376351-43-8C14H13Cl2F3N2O4
Ethyl 4-(4-bromophenyl)-6-hydroxy-1-methyl-2-oxo-6-(trifluoromethyl)hexahydropyrimidine-5-carboxylate chemical structure, C15H16BrF3N2O4, CAS 459150-30-2
Ethyl 4-(4-bromophenyl)-6-hydroxy-1-methyl-2-oxo-6-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
CAS 459150-30-2C15H16BrF3N2O4
Ethyl 6-(2,3-dimethoxyphenyl)-4-hydroxy-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate chemical structure, C16H19F3N2O6, CAS 459147-58-1
Ethyl 6-(2,3-dimethoxyphenyl)-4-hydroxy-2-oxo-4-(trifluoromethyl)hexahydropyrimidine-5-carboxylate
CAS 459147-58-1C16H19F3N2O6
5-Acetyl-6-(3,4-difluorophenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one chemical structure, C13H11F5N2O3, CAS 1005041-59-7
5-Acetyl-6-(3,4-difluorophenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
CAS 1005041-59-7C13H11F5N2O3
5-Acetyl-4-hydroxy-4-(trifluoromethyl)-6-(3,4,5-trimethoxyphenyl)-1,3-diazinan-2-one chemical structure, C16H19F3N2O6, CAS 1005041-62-2
5-Acetyl-4-hydroxy-4-(trifluoromethyl)-6-(3,4,5-trimethoxyphenyl)-1,3-diazinan-2-one
CAS 1005041-62-2C16H19F3N2O6
5-Acetyl-6-[2-(difluoromethoxy)phenyl]-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one chemical structure, C14H13F5N2O4, CAS 1005064-24-3
5-Acetyl-6-[2-(difluoromethoxy)phenyl]-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one
CAS 1005064-24-3C14H13F5N2O4
5-Acetyl-6-(3-fluorophenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one chemical structure, C13H12F4N2O3, CAS 1005064-14-1
5-Acetyl-6-(3-fluorophenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
CAS 1005064-14-1C13H12F4N2O3
5-Acetyl-6-(4-fluorophenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one chemical structure, C13H12F4N2O3, CAS 1005036-80-5
5-Acetyl-6-(4-fluorophenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
CAS 1005036-80-5C13H12F4N2O3
5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one chemical structure, C14H15F3N2O3, CAS 1005286-99-6
5-Acetyl-4-hydroxy-6-(3-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one
CAS 1005286-99-6C14H15F3N2O3
5-Acetyl-4-hydroxy-6-(4-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one chemical structure, C14H15F3N2O3, CAS 1005287-20-6
5-Acetyl-4-hydroxy-6-(4-methylphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one
CAS 1005287-20-6C14H15F3N2O3
5-Acetyl-4-hydroxy-6-(4-methoxyphenyl)-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one chemical structure, C14H15F3N2O4, CAS 380910-54-3
5-Acetyl-4-hydroxy-6-(4-methoxyphenyl)-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
CAS 380910-54-3C14H15F3N2O4
5-Acetyl-6-[4-(difluoromethoxy)phenyl]-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one chemical structure, C14H13F5N2O4, CAS 1005104-08-4
5-Acetyl-6-[4-(difluoromethoxy)phenyl]-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one
CAS 1005104-08-4C14H13F5N2O4
5-Acetyl-4-hydroxy-4-(trifluoromethyl)-6-[4-(trifluoromethyl)phenyl]-1,3-diazinan-2-one chemical structure, C14H12F6N2O3, CAS 1005074-21-4
5-Acetyl-4-hydroxy-4-(trifluoromethyl)-6-[4-(trifluoromethyl)phenyl]-1,3-diazinan-2-one
CAS 1005074-21-4C14H12F6N2O3
5-Acetyl-6-(4-chlorophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one chemical structure, C13H12ClF3N2O3, CAS 1005264-51-6
5-Acetyl-6-(4-chlorophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one
CAS 1005264-51-6C13H12ClF3N2O3
5-Acetyl-4-hydroxy-6-(2-hydroxy-5-nitrophenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one chemical structure, C13H12F3N3O6, CAS 1005264-46-9
5-Acetyl-4-hydroxy-6-(2-hydroxy-5-nitrophenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one
CAS 1005264-46-9C13H12F3N3O6
5-Acetyl-4-hydroxy-6-phenyl-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one chemical structure, C13H13F3N2O3, CAS 853783-14-9
5-Acetyl-4-hydroxy-6-phenyl-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one
CAS 853783-14-9C13H13F3N2O3
Methyl 4-[5-acetyl-6-hydroxy-2-oxo-6-(trifluoromethyl)-1,3-diazinan-4-yl]benzoate chemical structure, C15H15F3N2O5, CAS 1005037-99-9
Methyl 4-[5-acetyl-6-hydroxy-2-oxo-6-(trifluoromethyl)-1,3-diazinan-4-yl]benzoate
CAS 1005037-99-9C15H15F3N2O5
5-Acetyl-6-(4-bromophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one chemical structure, C13H12BrF3N2O3, CAS 1008079-51-3
5-Acetyl-6-(4-bromophenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one
CAS 1008079-51-3C13H12BrF3N2O3
Ethyl 4-hydroxy-6-(2-hydroxyphenyl)-2-oxo-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate chemical structure, C14H15F3N2O5, CAS 376351-44-9
Ethyl 4-hydroxy-6-(2-hydroxyphenyl)-2-oxo-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate
CAS 376351-44-9C14H15F3N2O5
2(1H)-Pyrimidinone, 4-ethoxytetrahydro-6-phenyl- chemical structure, C12H16N2O2, CAS 56546-31-7
2(1H)-Pyrimidinone, 4-ethoxytetrahydro-6-phenyl-
CAS 56546-31-7C12H16N2O2
6-(5-Chloro-2-hydroxyphenyl)-2-oxohexahydro-4-pyrimidinecarboxylic acid chemical structure, C11H11ClN2O4, CAS 449778-72-7
6-(5-Chloro-2-hydroxyphenyl)-2-oxohexahydro-4-pyrimidinecarboxylic acid
CAS 449778-72-7C11H11ClN2O4
Tetrahydro-4-(2-hydroxyphenyl)-2(1H)-pyrimidinone chemical structure, C10H12N2O2, CAS 857203-39-5
Tetrahydro-4-(2-hydroxyphenyl)-2(1H)-pyrimidinone
CAS 857203-39-5C10H12N2O2