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Murcko scaffold

1,6-Diphenylhexane scaffold

84 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
18
Chemicals
84
With full pages
7
Scaffold SMILES

c1ccc(CCCCCCc2ccccc2)cc1

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 scaffoldOpen the 1,6-Diphenylhexane page
Murcko scaffold c1ccc(CCCCCCc2ccccc2)cc1

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 84 chemicals

4,4'-Hexylidenebisphenol chemical structure, C18H22O2, CAS 24362-98-9
4,4'-Hexylidenebisphenol
CAS 24362-98-9C18H22O2
1,6-Diphenylhexane chemical structure, C18H22, CAS 1087-49-6
1,6-Diphenylhexane
CAS 1087-49-6C18H22
1,6-Di-(2,4-dinitro-phenyl)-hexane chemical structure, C18H18N4O8, CAS 6279-98-7
1,6-Di-(2,4-dinitro-phenyl)-hexane
CAS 6279-98-7C18H18N4O8
1,6-Bis(4-methoxyphenyl)hexane chemical structure, C20H26O2, CAS 4280-58-4
1,6-Bis(4-methoxyphenyl)hexane
CAS 4280-58-4C20H26O2
4,4'-Hexane-1,6-diyldibenzonitrile chemical structure, C20H20N2, CAS 10294-77-6
4,4'-Hexane-1,6-diyldibenzonitrile
CAS 10294-77-6C20H20N2
2,2'-Hexane-1,6-diyldibenzonitrile chemical structure, C20H20N2, CAS 10270-30-1
2,2'-Hexane-1,6-diyldibenzonitrile
CAS 10270-30-1C20H20N2
4,4'-Hexane-1,6-diylbis(n,n-dimethylbenzenesulfonamide) chemical structure, C22H32N2O4S2, CAS 13952-55-1
4,4'-Hexane-1,6-diylbis(n,n-dimethylbenzenesulfonamide)
CAS 13952-55-1C22H32N2O4S2
2,2'-Hexane-1,6-diylbis(n,n-dimethylaniline) chemical structure, C22H32N2, CAS 23829-35-8
2,2'-Hexane-1,6-diylbis(n,n-dimethylaniline)
CAS 23829-35-8C22H32N2
7-[2-(Dimethylamino)phenyl]-2-phenylheptanamide chemical structure, C21H28N2O, CAS 23754-33-8
7-[2-(Dimethylamino)phenyl]-2-phenylheptanamide
CAS 23754-33-8C21H28N2O
L-Iditol, 1,2,5,6-tetradeoxy-2,5-bis(((1,1-dimethylethoxy)carbonyl)amino)-1,6-diphenyl- chemical structure, C28H40N2O6, CAS 129491-63-0
L-Iditol, 1,2,5,6-tetradeoxy-2,5-bis(((1,1-dimethylethoxy)carbonyl)amino)-1,6-diphenyl-
CAS 129491-63-0C28H40N2O6
L-Mannitol, 1,2,5,6-tetradeoxy-2,5-bis(((1,1-dimethylethoxy)carbonyl)amino)-1,6-diphenyl- chemical structure, C28H40N2O6
L-Mannitol, 1,2,5,6-tetradeoxy-2,5-bis(((1,1-dimethylethoxy)carbonyl)amino)-1,6-diphenyl-
C28H40N2O6
L-Altritol, 1,2,5,6-tetradeoxy-2,5-bis(((1,1-dimethylethoxy)carbonyl)amino)-1,6-diphenyl- chemical structure, C28H40N2O6, CAS 129491-65-2
L-Altritol, 1,2,5,6-tetradeoxy-2,5-bis(((1,1-dimethylethoxy)carbonyl)amino)-1,6-diphenyl-
CAS 129491-65-2C28H40N2O6
Lasinavir chemical structure, C35H53N3O9, CAS 175385-62-3
Lasinavir
CAS 175385-62-3C35H53N3O9
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-4-[(4-hydroxyphenyl)methyl]-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-5-oxo-pentyl]carbamate chemical structure, C32H47N3O7, CAS 178048-28-7
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-4-[(4-hydroxyphenyl)methyl]-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-5-oxo-pentyl]carbamate
CAS 178048-28-7C32H47N3O7
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-4-[(4-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate chemical structure, C33H49N3O7, CAS 178047-91-1
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-4-[(4-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate
CAS 178047-91-1C33H49N3O7
tert-Butyl N-[(1S,2S,4R)-1-benzyl-5-[[(1S)-1-(2-dimethylaminoethylcarbamoyl)-2-methyl-propyl]amino]-2-hydroxy-4-[(4-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate chemical structure, C34H52N4O6, CAS 181038-30-2
tert-Butyl N-[(1S,2S,4R)-1-benzyl-5-[[(1S)-1-(2-dimethylaminoethylcarbamoyl)-2-methyl-propyl]amino]-2-hydroxy-4-[(4-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate
CAS 181038-30-2C34H52N4O6
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-4-[(3-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate chemical structure, C33H49N3O7, CAS 178048-32-3
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-4-[(3-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate
CAS 178048-32-3C33H49N3O7
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-4-[(2-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate chemical structure, C33H49N3O7, CAS 178048-35-6
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-4-[(2-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate
CAS 178048-35-6C33H49N3O7
tert-Butyl N-[(1S,2S,4R)-1-benzyl-5-[[(1S)-1-(2-dimethylaminoethylcarbamoyl)-2-methyl-propyl]amino]-2-hydroxy-4-[(2-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate chemical structure, C34H52N4O6, CAS 181038-36-8
tert-Butyl N-[(1S,2S,4R)-1-benzyl-5-[[(1S)-1-(2-dimethylaminoethylcarbamoyl)-2-methyl-propyl]amino]-2-hydroxy-4-[(2-methoxyphenyl)methyl]-5-oxo-pentyl]carbamate
CAS 181038-36-8C34H52N4O6
tert-Butyl N-[(1S,2S,4R)-1-benzyl-4-[(3,4-dimethoxyphenyl)methyl]-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-5-oxo-pentyl]carbamate chemical structure, C34H51N3O8, CAS 178048-31-2
tert-Butyl N-[(1S,2S,4R)-1-benzyl-4-[(3,4-dimethoxyphenyl)methyl]-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-5-oxo-pentyl]carbamate
CAS 178048-31-2C34H51N3O8
2,5,8,14-Tetraazapentadecan-15-oic acid, 10-((3,4-dimethoxyphenyl)methyl)-12-hydroxy-2-methyl-7-(1-methylethyl)-6,9-dioxo-13-(phenylmethyl)-,1,1-dimethylethyl ester, (7S-(7R*,10S*,12R*,13R*))- chemical structure, C35H54N4O7, CAS 181038-43-7
2,5,8,14-Tetraazapentadecan-15-oic acid, 10-((3,4-dimethoxyphenyl)methyl)-12-hydroxy-2-methyl-7-(1-methylethyl)-6,9-dioxo-13-(phenylmethyl)-,1,1-dimethylethyl ester, (7S-(7R*,10S*,12R*,13R*))-
CAS 181038-43-7C35H54N4O7
tert-Butyl N-[(1S,2S,4R)-1-benzyl-4-[(2,4-dimethoxyphenyl)methyl]-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-5-oxo-pentyl]carbamate chemical structure, C34H51N3O8, CAS 178048-34-5
tert-Butyl N-[(1S,2S,4R)-1-benzyl-4-[(2,4-dimethoxyphenyl)methyl]-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-5-oxo-pentyl]carbamate
CAS 178048-34-5C34H51N3O8
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-5-oxo-4-[(3,4,5-trimethoxyphenyl)methyl]pentyl]carbamate chemical structure, C35H53N3O9, CAS 178048-33-4
tert-Butyl N-[(1S,2S,4R)-1-benzyl-2-hydroxy-5-[[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]amino]-5-oxo-4-[(3,4,5-trimethoxyphenyl)methyl]pentyl]carbamate
CAS 178048-33-4C35H53N3O9
tert-Butyl N-[(1S,2S,4R)-1-benzyl-5-[[(1S)-1-(3-ethoxypropylcarbamoyl)-2-methyl-propyl]amino]-2-hydroxy-5-oxo-4-[(2,3,4-trimethoxyphenyl)methyl]pentyl]carbamate chemical structure, C37H57N3O9, CAS 178047-87-5
tert-Butyl N-[(1S,2S,4R)-1-benzyl-5-[[(1S)-1-(3-ethoxypropylcarbamoyl)-2-methyl-propyl]amino]-2-hydroxy-5-oxo-4-[(2,3,4-trimethoxyphenyl)methyl]pentyl]carbamate
CAS 178047-87-5C37H57N3O9