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Murcko scaffold

Ring system with 6 rings and 26 atoms

64 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
26
Chemicals
64
With full pages
14
Scaffold SMILES

c1ccc(C[N+]23CCC(CC2)CC3Cc2ccnc3ccccc23)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(C[N+]23CCC(CC2)CC3Cc2ccnc3ccccc23)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 64 chemicals

N-Benzylquininium chloride chemical structure, C27H31ClN2O2
N-Benzylquininium chloride
C27H31ClN2O2
N-Benzylquininium chloride (chiral phase-transfer catalyst) chemical structure, C27H31ClN2O2, CAS 67174-25-8
N-Benzylquininium chloride (chiral phase-transfer catalyst)
CAS 67174-25-8C27H31ClN2O2
(8alpha,9R)-9-Hydroxy-6'-methoxy-1-(phenylmethyl)cinchonanium chemical structure, C27H31N2O2+, CAS 116140-66-0
(8alpha,9R)-9-Hydroxy-6'-methoxy-1-(phenylmethyl)cinchonanium
CAS 116140-66-0C27H31N2O2+
N-Benzylcinchonidinium chloride chemical structure, C26H29ClN2O, CAS 69257-04-1
N-Benzylcinchonidinium chloride
CAS 69257-04-1C26H29ClN2O
(1S,2S,4S,5R)-1-Benzyl-2-((R)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium chloride chemical structure, C26H29ClN2O
(1S,2S,4S,5R)-1-Benzyl-2-((R)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium chloride
C26H29ClN2O
(9S)-1-Benzyl-9-hydroxycinchonanium chloride chemical structure, C26H29ClN2O, CAS 69221-14-3
(9S)-1-Benzyl-9-hydroxycinchonanium chloride
CAS 69221-14-3C26H29ClN2O
N-[4-(Trifluoromethyl)benzyl]cinchoninium bromide chemical structure, C27H28BrF3N2O
N-[4-(Trifluoromethyl)benzyl]cinchoninium bromide
C27H28BrF3N2O
(2S,4S,5R)-1-Benzyl-2-((R)-hydroxy(6-methoxyquinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium chloride chemical structure, C27H31ClN2O2
(2S,4S,5R)-1-Benzyl-2-((R)-hydroxy(6-methoxyquinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium chloride
C27H31ClN2O2
N-Benzylcinchoninium chloride chemical structure, C26H29ClN2O
N-Benzylcinchoninium chloride
C26H29ClN2O
(8S,9R)-(-)-N-Benzylcinchonidinium chloride chemical structure, C26H29ClN2O
(8S,9R)-(-)-N-Benzylcinchonidinium chloride
C26H29ClN2O
(1S,2R,4S,5R)-1-Benzyl-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide chemical structure, C26H29BrN2O, CAS 85653-34-5
(1S,2R,4S,5R)-1-Benzyl-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide
CAS 85653-34-5C26H29BrN2O
(S)-[(1S,2R,4S,5R)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol chemical structure, C26H29N2O+, CAS 111300-53-9
(S)-[(1S,2R,4S,5R)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol
CAS 111300-53-9C26H29N2O+
N-Benzylcinchonidinium bromide chemical structure, C26H29BrN2O, CAS 118089-84-2
N-Benzylcinchonidinium bromide
CAS 118089-84-2C26H29BrN2O
N-(4-Trifluoromethylbenzyl)cinchoninium bromide chemical structure, C27H28BrF3N2O, CAS 95088-20-3
N-(4-Trifluoromethylbenzyl)cinchoninium bromide
CAS 95088-20-3C27H28BrF3N2O
(1S,2R,4S,5R)-2-((S)-Hydroxy(quinolin-4-yl)methyl)-1-(4-(trifluoromethyl)benzyl)-5-vinylquinuclidin-1-ium bromide chemical structure, C27H28BrF3N2O
(1S,2R,4S,5R)-2-((S)-Hydroxy(quinolin-4-yl)methyl)-1-(4-(trifluoromethyl)benzyl)-5-vinylquinuclidin-1-ium bromide
C27H28BrF3N2O
(1S,2S,4S,5R)-2-((R)-Hydroxy(quinolin-4-yl)methyl)-1-(4-(trifluoromethyl)benzyl)-5-vinylquinuclidin-1-ium bromide chemical structure, C27H28BrF3N2O, CAS 101311-12-0
(1S,2S,4S,5R)-2-((R)-Hydroxy(quinolin-4-yl)methyl)-1-(4-(trifluoromethyl)benzyl)-5-vinylquinuclidin-1-ium bromide
CAS 101311-12-0C27H28BrF3N2O
O-Allyl-N-benzylcinchonidinium bromide chemical structure, C29H33BrN2O, CAS 158195-40-5
O-Allyl-N-benzylcinchonidinium bromide
CAS 158195-40-5C29H33BrN2O
(1R)[(1S,4S,5R)-1-benzyl-5-vinylquinuclidin-2-yl]-4-quinolylmethan-1-ol, chlor ide chemical structure, C26H29ClN2O
(1R)[(1S,4S,5R)-1-benzyl-5-vinylquinuclidin-2-yl]-4-quinolylmethan-1-ol, chlor ide
C26H29ClN2O
(2R,4S,5R)-1-Benzyl-2-((S)-hydroxy(6-methoxyquinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium chloride chemical structure, C27H31ClN2O2, CAS 77481-82-4
(2R,4S,5R)-1-Benzyl-2-((S)-hydroxy(6-methoxyquinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium chloride
CAS 77481-82-4C27H31ClN2O2
(S)-[(2R,4R,5R)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol chloride chemical structure, C27H31ClN2O2
(S)-[(2R,4R,5R)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol chloride
C27H31ClN2O2
(R)-[(2R,4S,5R)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol chloride chemical structure, C26H29ClN2O
(R)-[(2R,4S,5R)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol chloride
C26H29ClN2O
(R)-[(2R)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol chloride chemical structure, C26H29ClN2O
(R)-[(2R)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol chloride
C26H29ClN2O
(1S,2S,4S,5R)-1-(3,5-Bis(trifluoromethyl)benzyl)-2-((R)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide chemical structure, C28H27BrF6N2O, CAS 947508-16-9
(1S,2S,4S,5R)-1-(3,5-Bis(trifluoromethyl)benzyl)-2-((R)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide
CAS 947508-16-9C28H27BrF6N2O
(S)-[(2R,4R,5S)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol chloride chemical structure, C26H29ClN2O
(S)-[(2R,4R,5S)-1-Benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol chloride
C26H29ClN2O