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Murcko scaffold

Ring system with 2 rings and 20 atoms

25 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
20
Chemicals
25
With full pages
6
Scaffold SMILES

c1ccc(CNCCOCCOc2ccccc2)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 scaffold
Murcko scaffold c1ccc(CNCCOCCOc2ccccc2)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 25 of 25 chemicals

Benzethonium chemical structure, C27H42NO2+, CAS 10172-60-8
Benzethonium
CAS 10172-60-8C27H42NO2+
Methylbenzethonium chemical structure, C28H44NO2+, CAS 72013-76-4
Methylbenzethonium
CAS 72013-76-4C28H44NO2+
Benzethonium chloride chemical structure, C27H42ClNO2, CAS 121-54-0
Benzethonium chloride
CAS 121-54-0C27H42ClNO2
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-M-tolyl)oxy)ethoxy)ethyl)ammonium chloride chemical structure, C28H44ClNO2, CAS 15716-02-6
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-M-tolyl)oxy)ethoxy)ethyl)ammonium chloride
CAS 15716-02-6C28H44ClNO2
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-m-tolyl)oxy)ethoxy)ethyl)ammonium chemical structure, C28H44NO2+, CAS 58431-62-2
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-m-tolyl)oxy)ethoxy)ethyl)ammonium
CAS 58431-62-2C28H44NO2+
Ammonium, benzyldimethyl(2-(2-(p-1,1,3,3-tetramethylbutylphenoxy)ethoxy)ethyl)-, thiocyanate chemical structure, C28H42N2O2S, CAS 64048-43-7
Ammonium, benzyldimethyl(2-(2-(p-1,1,3,3-tetramethylbutylphenoxy)ethoxy)ethyl)-, thiocyanate
CAS 64048-43-7C28H42N2O2S
Ammonium, (p-chlorobenzyl)(2-(2-(6-chloro-2,4-bis(1-ethylpropyl)phenoxy)ethoxy)ethyl)dimethyl-, chloride chemical structure, C29H44Cl3NO2, CAS 66902-76-9
Ammonium, (p-chlorobenzyl)(2-(2-(6-chloro-2,4-bis(1-ethylpropyl)phenoxy)ethoxy)ethyl)dimethyl-, chloride
CAS 66902-76-9C29H44Cl3NO2
Ammonium, (p-chlorobenzyl)(2-(2-(4-chloro-3,5-dimethylphenoxy)ethoxy)ethyl)dimethyl-, chloride chemical structure, C21H28Cl3NO2, CAS 66902-77-0
Ammonium, (p-chlorobenzyl)(2-(2-(4-chloro-3,5-dimethylphenoxy)ethoxy)ethyl)dimethyl-, chloride
CAS 66902-77-0C21H28Cl3NO2
((4-(2-Methyl-2-butyl)-2-chlorophenoxy)ethoxyethyl)(4-chlorobenzyl)dimethylammonium chloride chemical structure, C24H34Cl3NO2, CAS 66902-78-1
((4-(2-Methyl-2-butyl)-2-chlorophenoxy)ethoxyethyl)(4-chlorobenzyl)dimethylammonium chloride
CAS 66902-78-1C24H34Cl3NO2
Ammonium, (p-chlorobenzyl)(2-(2-(4-chloro-2-isopropyl-5-methylphenoxy)ethoxy)ethyl)dimethyl-, chloride chemical structure, C23H32Cl3NO2, CAS 66902-79-2
Ammonium, (p-chlorobenzyl)(2-(2-(4-chloro-2-isopropyl-5-methylphenoxy)ethoxy)ethyl)dimethyl-, chloride
CAS 66902-79-2C23H32Cl3NO2
Benzenemethanaminium, N,N-bis(2-methylpropyl)-N-[2-(2-phenoxyethoxy)ethyl]-, chloride (1:1) chemical structure, C25H38ClNO2, CAS 22616-31-5
Benzenemethanaminium, N,N-bis(2-methylpropyl)-N-[2-(2-phenoxyethoxy)ethyl]-, chloride (1:1)
CAS 22616-31-5C25H38ClNO2
BZC jelly chemical structure, C43H61ClN2O5, CAS 88645-24-3
BZC jelly
CAS 88645-24-3C43H61ClN2O5
Methylbenzethonium hydroxide chemical structure, C28H45NO3, CAS 26248-39-5
Methylbenzethonium hydroxide
CAS 26248-39-5C28H45NO3
TG 89 chemical structure, C42H59ClNNaO5S, CAS 136128-69-3
TG 89
CAS 136128-69-3C42H59ClNNaO5S
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-o-tolyl)oxy)ethoxy)ethyl)ammonium chloride chemical structure, C28H44ClNO2, CAS 101912-16-7
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-o-tolyl)oxy)ethoxy)ethyl)ammonium chloride
CAS 101912-16-7C28H44ClNO2
N-Benzyl-N,N-dimethyl-2-(2-(4-(2,4,4-trimethylpentan-2-yl)phenoxy)ethoxy)ethanaminium hydroxide chemical structure, C27H43NO3, CAS 498-77-1
N-Benzyl-N,N-dimethyl-2-(2-(4-(2,4,4-trimethylpentan-2-yl)phenoxy)ethoxy)ethanaminium hydroxide
CAS 498-77-1C27H43NO3
Benzethonium chloride monohydrate chemical structure, C27H44ClNO3, CAS 5929-09-9
Benzethonium chloride monohydrate
CAS 5929-09-9C27H44ClNO3
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-m-tolyl)oxy)ethoxy)ethyl)ammonium chloride monohydrate chemical structure, C28H46ClNO3, CAS 10139-80-7
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-m-tolyl)oxy)ethoxy)ethyl)ammonium chloride monohydrate
CAS 10139-80-7C28H46ClNO3
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-o-tolyl)oxy)ethoxy)ethyl)ammonium chloride monohydrate chemical structure, C28H46ClNO3, CAS 6032-24-2
Benzyldimethyl(2-(2-((4-(1,1,3,3-tetramethylbutyl)-o-tolyl)oxy)ethoxy)ethyl)ammonium chloride monohydrate
CAS 6032-24-2C28H46ClNO3
Benzethonium octyloxyacetate chemical structure, C37H61NO5, CAS 7563-43-1
Benzethonium octyloxyacetate
CAS 7563-43-1C37H61NO5
p-(1,1,3,3-Tetramethylbutyl)phenoxyethoxyethyl dimethyl benzyl ammonium tetrachloromercurate (2-) (2:1) chemical structure, C54H84Cl4HgN2O4, CAS 53433-01-5
p-(1,1,3,3-Tetramethylbutyl)phenoxyethoxyethyl dimethyl benzyl ammonium tetrachloromercurate (2-) (2:1)
CAS 53433-01-5C54H84Cl4HgN2O4
N-Benzyl-N,N-dimethyl-2-{2-[4-methyl-2,6-bis(2-methylpropyl)phenoxy]ethoxy}ethanaminium chemical structure, C28H44NO2+, CAS 1255237-86-5
N-Benzyl-N,N-dimethyl-2-{2-[4-methyl-2,6-bis(2-methylpropyl)phenoxy]ethoxy}ethanaminium
CAS 1255237-86-5C28H44NO2+
N-Benzyl-N,N-dimethyl-2-{2-[4-methyl-2,6-bis(2-methylpropyl)phenoxy]ethoxy}ethanaminium chloride chemical structure, C28H44ClNO2, CAS 1255143-35-1
N-Benzyl-N,N-dimethyl-2-{2-[4-methyl-2,6-bis(2-methylpropyl)phenoxy]ethoxy}ethanaminium chloride
CAS 1255143-35-1C28H44ClNO2
N-(4-Chlorobenzyl)-N,N-dimethyl-2-[2-(4-octylphenoxy)ethoxy]ethanaminium chloride chemical structure, C27H41Cl2NO2, CAS 10106-15-7
N-(4-Chlorobenzyl)-N,N-dimethyl-2-[2-(4-octylphenoxy)ethoxy]ethanaminium chloride
CAS 10106-15-7C27H41Cl2NO2