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Murcko scaffold

Ring system with 5 rings and 33 atoms

13 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
33
Chemicals
13
With full pages
3
Scaffold SMILES

c1ccc(N=Nc2ccc(N=Nc3ccc4cc(Nc5ncncn5)ccc4c3)cc2)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(N=Nc2ccc(N=Nc3ccc4cc(Nc5ncncn5)ccc4c3)cc2)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 13 of 13 chemicals

2-Naphthalenesulfonic acid, 7-((4,6-bis((3-(diethylamino)propyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-(phenylazo)phenyl)azo)-, monoacetate (salt) chemical structure, C41H54N12O6S, CAS 71032-95-6
2-Naphthalenesulfonic acid, 7-((4,6-bis((3-(diethylamino)propyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-(phenylazo)phenyl)azo)-, monoacetate (salt)
CAS 71032-95-6C41H54N12O6S
7-[(4,6-Bis{[3-(diethylamino)propyl]amino}-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-{[4-(phenyldiazenyl)phenyl]diazenyl}naphthalene-2-sulfonic acid chemical structure, C39H50N12O4S, CAS 71032-94-5
7-[(4,6-Bis{[3-(diethylamino)propyl]amino}-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-{[4-(phenyldiazenyl)phenyl]diazenyl}naphthalene-2-sulfonic acid
CAS 71032-94-5C39H50N12O4S
C.i. direct red 253 chemical structure, C29H26N10Na2O9S2, CAS 68201-95-6
C.i. direct red 253
CAS 68201-95-6C29H26N10Na2O9S2
RefChem:88591 chemical structure, C39H48N12Na2O7S2, CAS 120029-06-3
RefChem:88591
CAS 120029-06-3C39H48N12Na2O7S2
Cuprate(3-), (2-((4-((6-((4-amino-6-fluoro-1,3,5-triazin-2-yl)methylamino)-1-(hydroxy-kappaO)-3-sulfo-2-naphthalenyl)azo-kappaN1)-5-(hydroxy-kappaO)-2-methylphenyl)azo)-1,4-benzenedisulfonato(5-))-, trisodium chemical structure, C27H22CuFN9Na3O11S3+3, CAS 70529-02-1
Cuprate(3-), (2-((4-((6-((4-amino-6-fluoro-1,3,5-triazin-2-yl)methylamino)-1-(hydroxy-kappaO)-3-sulfo-2-naphthalenyl)azo-kappaN1)-5-(hydroxy-kappaO)-2-methylphenyl)azo)-1,4-benzenedisulfonato(5-))-, trisodium
CAS 70529-02-1C27H22CuFN9Na3O11S3+3
2-Naphthalenesulfonic acid, 7-((4-fluoro-6-((2-sulfoethyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-sulfo-4-((4-sulfophenyl)azo)phenyl)azo)-, lithium potassium sodium salt chemical structure, C27H18FKLiN9NaO13S4-, CAS 141557-57-5
2-Naphthalenesulfonic acid, 7-((4-fluoro-6-((2-sulfoethyl)amino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-sulfo-4-((4-sulfophenyl)azo)phenyl)azo)-, lithium potassium sodium salt
CAS 141557-57-5C27H18FKLiN9NaO13S4-
Disodium 7-((4-chloro-6-(dodecylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-((4-sulfonatophenyl)diazen-1-yl)phenyl)diazen-1-yl)naphthalene-2-sulfonate chemical structure, C37H40ClN9Na2O7S2, CAS 145703-76-0
Disodium 7-((4-chloro-6-(dodecylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-((4-sulfonatophenyl)diazen-1-yl)phenyl)diazen-1-yl)naphthalene-2-sulfonate
CAS 145703-76-0C37H40ClN9Na2O7S2
Trihydrogen (2-((4-((6-((4,6-dichloro-1,3,5-triazin-2-yl)methylamino)-1-hydroxy-3-sulpho-2-naphthyl)azo)-5-hydroxy-o-tolyl)azo)benzene-1,4-disulphonato(5-))cuprate(3-) chemical structure, C27H23Cl2CuN8O11S3+3, CAS 93858-41-4
Trihydrogen (2-((4-((6-((4,6-dichloro-1,3,5-triazin-2-yl)methylamino)-1-hydroxy-3-sulpho-2-naphthyl)azo)-5-hydroxy-o-tolyl)azo)benzene-1,4-disulphonato(5-))cuprate(3-)
CAS 93858-41-4C27H23Cl2CuN8O11S3+3
Trihydrogen (2-((4-((6-((4-amino-6-chloro-1,3,5-triazin-2-yl)methylamino)-1-hydroxy-3-sulpho-2-naphthyl)azo)-5-hydroxy-o-tolyl)azo)benzene-1,4-disulphonato(5-))cuprate(3-) chemical structure, C27H25ClCuN9O11S3+3, CAS 35718-34-4
Trihydrogen (2-((4-((6-((4-amino-6-chloro-1,3,5-triazin-2-yl)methylamino)-1-hydroxy-3-sulpho-2-naphthyl)azo)-5-hydroxy-o-tolyl)azo)benzene-1,4-disulphonato(5-))cuprate(3-)
CAS 35718-34-4C27H25ClCuN9O11S3+3
7-[[4,6-Bis[3-(diethylamino)propylamino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-phenyldiazenylphenyl)diazenyl]naphthalene-2-sulfonic acid, 2-hydroxypropanoic acid chemical structure, C42H56N12O7S, CAS 125329-01-3
7-[[4,6-Bis[3-(diethylamino)propylamino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(4-phenyldiazenylphenyl)diazenyl]naphthalene-2-sulfonic acid, 2-hydroxypropanoic acid
CAS 125329-01-3C42H56N12O7S
3-[[4-[3-(Diethylamino)propylamino]-6-[[5-hydroxy-6-[(4-phenyldiazenylphenyl)diazenyl]-7-sulfonaphthalen-2-yl]amino]-1,3,5-triazin-2-yl]amino]propyl-diethylazanium acetate chemical structure, C41H54N12O6S
3-[[4-[3-(Diethylamino)propylamino]-6-[[5-hydroxy-6-[(4-phenyldiazenylphenyl)diazenyl]-7-sulfonaphthalen-2-yl]amino]-1,3,5-triazin-2-yl]amino]propyl-diethylazanium acetate
C41H54N12O6S
Cuprate(3-), [2-[2-[4-[2-[6-[(4-amino-6-fluoro-1,3,5-triazin-2-yl)methylamino]-1-(hydroxy-kappaO)-3-sulfo-2-naphthalenyl]diazenyl-kappaN1]-5-(hydroxy-kappaO)-2-methylphenyl]diazenyl]-1,4-benzenedisulfonato(5-)]-, sodium (1:3) chemical structure, C27H17CuFN9Na3O11S3
Cuprate(3-), [2-[2-[4-[2-[6-[(4-amino-6-fluoro-1,3,5-triazin-2-yl)methylamino]-1-(hydroxy-kappaO)-3-sulfo-2-naphthalenyl]diazenyl-kappaN1]-5-(hydroxy-kappaO)-2-methylphenyl]diazenyl]-1,4-benzenedisulfonato(5-)]-, sodium (1:3)
C27H17CuFN9Na3O11S3
Copper, trisodium, 2-[[4-[[6-[(4-amino-6-chloro-1,3,5-triazin-2-yl)-methylamino]-1-oxido-3-sulfonatonaphthalen-2-yl]diazenyl]-2-methyl-5-oxidophenyl]diazenyl]benzene-1,4-disulfonate chemical structure, C27H17ClCuN9Na3O11S3, CAS 70236-53-2
Copper, trisodium, 2-[[4-[[6-[(4-amino-6-chloro-1,3,5-triazin-2-yl)-methylamino]-1-oxido-3-sulfonatonaphthalen-2-yl]diazenyl]-2-methyl-5-oxidophenyl]diazenyl]benzene-1,4-disulfonate
CAS 70236-53-2C27H17ClCuN9Na3O11S3