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Murcko scaffold

Ring system with 5 rings and 26 atoms

18 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
26
Chemicals
18
With full pages
3
Scaffold SMILES

C(=Cc1c(-c2ccccc2)[nH]c2ccccc12)C1=Nc2ccccc2C1

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 C(=Cc1c(-c2ccccc2)[nH]c2ccccc12)C1=Nc2ccccc2C1

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 18 of 18 chemicals

1,3,3-Trimethyl-2-[2-(1-methyl-2-phenylindol-3-yl)ethenyl]indol-1-ium, chloride chemical structure, C28H27ClN2
1,3,3-Trimethyl-2-[2-(1-methyl-2-phenylindol-3-yl)ethenyl]indol-1-ium, chloride
C28H27ClN2
3H-Indolium, 5-methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)ethenyl)-, chloride (1:1) chemical structure, C29H29ClN2O, CAS 54060-93-4
3H-Indolium, 5-methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)ethenyl)-, chloride (1:1)
CAS 54060-93-4C29H29ClN2O
3-[2-(3,3-Dimethyl-3H-indol-2-yl)ethenyl]-1-ethyl-2-phenyl-1H-indole chemical structure, C28H26N2, CAS 90162-56-4
3-[2-(3,3-Dimethyl-3H-indol-2-yl)ethenyl]-1-ethyl-2-phenyl-1H-indole
CAS 90162-56-4C28H26N2
(E)-5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indol-1-ium chloride chemical structure, C29H29ClN2O, CAS 5538-87-4
(E)-5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indol-1-ium chloride
CAS 5538-87-4C29H29ClN2O
5-Methoxy-1,3,3-trimethyl-2-[2-(1-methyl-2-phenyl-1H-indol-3-yl)ethenyl]-3H-indolium chemical structure, C29H29N2O+, CAS 37713-35-2
5-Methoxy-1,3,3-trimethyl-2-[2-(1-methyl-2-phenyl-1H-indol-3-yl)ethenyl]-3H-indolium
CAS 37713-35-2C29H29N2O+
1,3,3-Trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium chloride chemical structure, C28H27ClN2, CAS 4657-00-5
1,3,3-Trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium chloride
CAS 4657-00-5C28H27ClN2
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium acetate chemical structure, C31H32N2O3, CAS 83969-06-6
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium acetate
CAS 83969-06-6C31H32N2O3
1,3,3-Trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium acetate chemical structure, C30H30N2O2, CAS 83969-08-8
1,3,3-Trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium acetate
CAS 83969-08-8C30H30N2O2
1-[4-[(Acetylamino)sulphonyl]butyl]-2-[2-[2-(4-chlorophenyl)-1-methyl-1H-indol-3-yl]vinyl]-5-(methoxycarbonyl)-3,3-dimethyl-3H-indolium bromide chemical structure, C35H37BrClN3O5S, CAS 84100-41-4
1-[4-[(Acetylamino)sulphonyl]butyl]-2-[2-[2-(4-chlorophenyl)-1-methyl-1H-indol-3-yl]vinyl]-5-(methoxycarbonyl)-3,3-dimethyl-3H-indolium bromide
CAS 84100-41-4C35H37BrClN3O5S
2-(2-(2-(4-Chlorophenyl)-1-methyl-1H-indol-3-yl)vinyl)-5-(methoxycarbonyl)-1,3,3-trimethyl-3H-indolium iodide chemical structure, C30H28ClIN2O2, CAS 84434-34-4
2-(2-(2-(4-Chlorophenyl)-1-methyl-1H-indol-3-yl)vinyl)-5-(methoxycarbonyl)-1,3,3-trimethyl-3H-indolium iodide
CAS 84434-34-4C30H28ClIN2O2
5-((2-Ethoxy-2-oxoethoxy)carbonyl)-1,3,3-trimethyl-2-(2-(5-nitro-1-(2-oxo-2-(2-oxopropoxy)ethyl)-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium iodide chemical structure, C37H36IN3O9, CAS 85029-83-0
5-((2-Ethoxy-2-oxoethoxy)carbonyl)-1,3,3-trimethyl-2-(2-(5-nitro-1-(2-oxo-2-(2-oxopropoxy)ethyl)-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium iodide
CAS 85029-83-0C37H36IN3O9
5-((Difluoromethyl)sulphonyl)-2-(2-(1-(3-methoxy-3-oxopropyl)-2-phenyl-1H-indol-3-yl)vinyl)-1,3,3-trimethyl-3H-indolium iodide chemical structure, C32H31F2IN2O4S, CAS 85050-04-0
5-((Difluoromethyl)sulphonyl)-2-(2-(1-(3-methoxy-3-oxopropyl)-2-phenyl-1H-indol-3-yl)vinyl)-1,3,3-trimethyl-3H-indolium iodide
CAS 85050-04-0C32H31F2IN2O4S
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium hydrogen sulphate chemical structure, C29H30N2O5S, CAS 85283-78-9
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium hydrogen sulphate
CAS 85283-78-9C29H30N2O5S
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium methyl sulphate chemical structure, C30H32N2O5S, CAS 85294-28-6
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium methyl sulphate
CAS 85294-28-6C30H32N2O5S
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium dihydrogen phosphate chemical structure, C29H31N2O5P, CAS 83969-05-5
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium dihydrogen phosphate
CAS 83969-05-5C29H31N2O5P
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium sulphate (2:1) chemical structure, C58H58N4O6S, CAS 85283-79-0
5-Methoxy-1,3,3-trimethyl-2-(2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl)-3H-indolium sulphate (2:1)
CAS 85283-79-0C58H58N4O6S
1,3,3-Trimethyl-2-[2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl]-3H-indolium dihydrogen phosphate chemical structure, C28H29N2O4P, CAS 35033-71-7
1,3,3-Trimethyl-2-[2-(1-methyl-2-phenyl-1H-indol-3-yl)vinyl]-3H-indolium dihydrogen phosphate
CAS 35033-71-7C28H29N2O4P
3-[2-(3,3-Dimethyl-5-propyl-1,3-dihydro-2H-indol-2-ylidene)ethylidene]-2-phenyl-3H-indole chemical structure, C29H28N2, CAS 90162-46-2
3-[2-(3,3-Dimethyl-5-propyl-1,3-dihydro-2H-indol-2-ylidene)ethylidene]-2-phenyl-3H-indole
CAS 90162-46-2C29H28N2