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Murcko scaffold

1-Benzyl-3,5,7-triaza-1-azoniatricyclo(3.3.1.13,7)decane chloride scaffold

10 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
17
Chemicals
10
With full pages
2
Scaffold SMILES

c1ccc(C[N+]23CN4CN(CN(C4)C2)C3)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-Benzyl-3,5,7-triaza-1-azoniatricyclo(3.3.1.13,7)decane chloride page
Murcko scaffold c1ccc(C[N+]23CN4CN(CN(C4)C2)C3)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 10 of 10 chemicals

1-Benzyl-3,5,7-triaza-1-azoniatricyclo(3.3.1.13,7)decane chloride chemical structure, C13H19N4+, CAS 5400-93-1
1-Benzyl-3,5,7-triaza-1-azoniatricyclo(3.3.1.13,7)decane chloride
CAS 5400-93-1C13H19N4+
1-(2-Chloro-6-fluorobenzyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.1~3,7~]decane chloride chemical structure, C13H17Cl2FN4, CAS 848611-91-6
1-(2-Chloro-6-fluorobenzyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.1~3,7~]decane chloride
CAS 848611-91-6C13H17Cl2FN4
1-(3-Carboxy-4-methoxybenzyl)-1,3,5,7-tetraazaadamantan-1-ium chloride chemical structure, C15H21ClN4O3, CAS 748134-95-4
1-(3-Carboxy-4-methoxybenzyl)-1,3,5,7-tetraazaadamantan-1-ium chloride
CAS 748134-95-4C15H21ClN4O3
Roslin 2 chemical structure, C13H19BrN4, CAS 29574-21-8
Roslin 2
CAS 29574-21-8C13H19BrN4
Trifluoro(4-((1,3,5,7-tetraazatricyclo[3.3.1.1<3,7>]decyl)methyl)phenylthio)methane, hydrobromide chemical structure, C14H18BrF3N4S, CAS 1294450-67-1
Trifluoro(4-((1,3,5,7-tetraazatricyclo[3.3.1.1<3,7>]decyl)methyl)phenylthio)methane, hydrobromide
CAS 1294450-67-1C14H18BrF3N4S
1-(2-(Chloromethyl)benzyl)-3,5,7-triaza-1-azoniatricyclo(3.3.1.13,7)decane chloride chemical structure, C14H20Cl2N4, CAS 24793-77-9
1-(2-(Chloromethyl)benzyl)-3,5,7-triaza-1-azoniatricyclo(3.3.1.13,7)decane chloride
CAS 24793-77-9C14H20Cl2N4
Methenamine iodobenzylate chemical structure, C13H20IN4+, CAS 6197-44-0
Methenamine iodobenzylate
CAS 6197-44-0C13H20IN4+
3,5,7-Triaza-1-azoniatricyclo[3.3.1.13,7]decane, 1-[(5-amino-2-hydroxyphenyl)methyl]-, chloride chemical structure, C13H20ClN5O, CAS 26034-31-1
3,5,7-Triaza-1-azoniatricyclo[3.3.1.13,7]decane, 1-[(5-amino-2-hydroxyphenyl)methyl]-, chloride
CAS 26034-31-1C13H20ClN5O
1-(2,4-Dichlorobenzyl)-1,3,5,7-tetraazaadamantan-1-ium chloride chemical structure, C13H17Cl3N4, CAS 109435-08-7
1-(2,4-Dichlorobenzyl)-1,3,5,7-tetraazaadamantan-1-ium chloride
CAS 109435-08-7C13H17Cl3N4
1-[(2,4-Dichlorophenyl)methyl]-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane chemical structure, C13H17Cl2N4+, CAS 147028-65-7
1-[(2,4-Dichlorophenyl)methyl]-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane
CAS 147028-65-7C13H17Cl2N4+