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Murcko scaffold

Ring system with 3 rings and 21 atoms

96 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
96
With full pages
19
Scaffold SMILES

O=C1C(=Cc2ccccc2)CCCC1=Cc1ccccc1

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=C1C(=Cc2ccccc2)CCCC1=Cc1ccccc1

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 96 chemicals

Cyclovalone chemical structure, C22H22O5, CAS 579-23-7
Cyclovalone
CAS 579-23-7C22H22O5
Cyclohexanone, 2,6-bis[(4-azidophenyl)methylene]-4-methyl- chemical structure, C21H18N6O
Cyclohexanone, 2,6-bis[(4-azidophenyl)methylene]-4-methyl-
C21H18N6O
2,6-Bis(m-nitrobenzylidene)cyclohexan-1-one chemical structure, C20H16N2O5, CAS 18977-36-1
2,6-Bis(m-nitrobenzylidene)cyclohexan-1-one
CAS 18977-36-1C20H16N2O5
2,6-Bis(p-methylbenzylidene)cyclohexanone chemical structure, C22H22O, CAS 18989-35-0
2,6-Bis(p-methylbenzylidene)cyclohexanone
CAS 18989-35-0C22H22O
2,6-Bis(o-chlorobenzylidene)cyclohexan-1-one chemical structure, C20H16Cl2O
2,6-Bis(o-chlorobenzylidene)cyclohexan-1-one
C20H16Cl2O
2,6-Bis(4-chlorobenzylidene)cyclohexanone chemical structure, C20H16Cl2O, CAS 18989-82-7
2,6-Bis(4-chlorobenzylidene)cyclohexanone
CAS 18989-82-7C20H16Cl2O
2,6-Bis[(4-fluorophenyl)methylidene]cyclohexan-1-one chemical structure, C20H16F2O, CAS 395-12-0
2,6-Bis[(4-fluorophenyl)methylidene]cyclohexan-1-one
CAS 395-12-0C20H16F2O
2,6-Bis(4-dimethylaminobenzylidene)cyclohexanone chemical structure, C24H28N2O, CAS 18977-38-3
2,6-Bis(4-dimethylaminobenzylidene)cyclohexanone
CAS 18977-38-3C24H28N2O
2,6-Bis(2,4-dichlorobenzylidene)cyclohexanone chemical structure, C20H14Cl4O
2,6-Bis(2,4-dichlorobenzylidene)cyclohexanone
C20H14Cl4O
2,6-Bis(3,4-dichlorobenzylidene)cyclohexanone chemical structure, C20H14Cl4O, CAS 18989-80-5
2,6-Bis(3,4-dichlorobenzylidene)cyclohexanone
CAS 18989-80-5C20H14Cl4O
Cyclohexanone, 2,6-bis[(4-bromophenyl)methylene]-, (E,E)- chemical structure, C20H16Br2O
Cyclohexanone, 2,6-bis[(4-bromophenyl)methylene]-, (E,E)-
C20H16Br2O
Cyclohexanone, 2,6-bis[(3-fluoro-4-hydroxyphenyl)methylene]- chemical structure, C20H16F2O3, CAS 748799-10-2
Cyclohexanone, 2,6-bis[(3-fluoro-4-hydroxyphenyl)methylene]-
CAS 748799-10-2C20H16F2O3
2,6-Dibenzylidene-4-methylcyclohexan-1-one chemical structure, C21H20O, CAS 19186-11-9
2,6-Dibenzylidene-4-methylcyclohexan-1-one
CAS 19186-11-9C21H20O
(6E)-2,6-Bis[(4-fluorophenyl)methylidene]cyclohexan-1-one chemical structure, C20H16F2O
(6E)-2,6-Bis[(4-fluorophenyl)methylidene]cyclohexan-1-one
C20H16F2O
Cyclohexanone, 2,6-bis[(4-methoxyphenyl)methylene]-4-methyl- chemical structure, C23H24O3, CAS 25663-52-9
Cyclohexanone, 2,6-bis[(4-methoxyphenyl)methylene]-4-methyl-
CAS 25663-52-9C23H24O3
2,6-Bis[(3,4-dimethoxyphenyl)methylidene]cyclohexan-1-one chemical structure, C24H26O5
2,6-Bis[(3,4-dimethoxyphenyl)methylidene]cyclohexan-1-one
C24H26O5
2,6-Bis(2,5-dimethoxybenzylidene)-4-methylcyclohexan-1-one chemical structure, C25H28O5, CAS 346445-21-4
2,6-Bis(2,5-dimethoxybenzylidene)-4-methylcyclohexan-1-one
CAS 346445-21-4C25H28O5
Cyclohexanone, 2,6-bis[[4-(dimethylamino)phenyl]methylene]-4-methyl- chemical structure, C25H30N2O, CAS 65446-46-0
Cyclohexanone, 2,6-bis[[4-(dimethylamino)phenyl]methylene]-4-methyl-
CAS 65446-46-0C25H30N2O
(2Z,6E)-2,6-Dibenzylidenecyclohexanone chemical structure, C20H18O, CAS 251909-29-2
(2Z,6E)-2,6-Dibenzylidenecyclohexanone
CAS 251909-29-2C20H18O
2,6-Dibenzylidenecyclohexanone chemical structure, C20H18O, CAS 897-78-9
2,6-Dibenzylidenecyclohexanone
CAS 897-78-9C20H18O
Cyclohexanone, 2,6-bis(p-methoxybenzylidene)- chemical structure, C22H22O3, CAS 2986420-21-5
Cyclohexanone, 2,6-bis(p-methoxybenzylidene)-
CAS 2986420-21-5C22H22O3
2,6-Bis(4-methoxybenzylidene)cyclohexanone chemical structure, C22H22O3, CAS 6275-32-7
2,6-Bis(4-methoxybenzylidene)cyclohexanone
CAS 6275-32-7C22H22O3
(2E,6E)-2,6-Bis[(4-chlorophenyl)methylidene]cyclohexan-1-one chemical structure, C20H16Cl2O, CAS 42792-80-3
(2E,6E)-2,6-Bis[(4-chlorophenyl)methylidene]cyclohexan-1-one
CAS 42792-80-3C20H16Cl2O
(2E,6Z)-2,6-Bis[(4-fluorophenyl)methylidene]cyclohexan-1-one chemical structure, C20H16F2O, CAS 1321785-61-8
(2E,6Z)-2,6-Bis[(4-fluorophenyl)methylidene]cyclohexan-1-one
CAS 1321785-61-8C20H16F2O