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Murcko scaffold

Ring system with 3 rings and 17 atoms

11 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
11
With full pages
2
Scaffold SMILES

c1cc(CN2CCCC2)cc(B2OCCO2)c1

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 c1cc(CN2CCCC2)cc(B2OCCO2)c1

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 11 of 11 chemicals

1-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine chemical structure, C17H26BNO2, CAS 884507-45-3
1-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine
CAS 884507-45-3C17H26BNO2
1-(2-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine chemical structure, C17H25BFNO2, CAS 1256360-38-9
1-(2-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine
CAS 1256360-38-9C17H25BFNO2
1-(4-Chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine chemical structure, C17H25BClNO2, CAS 2096333-77-4
1-(4-Chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine
CAS 2096333-77-4C17H25BClNO2
1-(4-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine chemical structure, C17H25BFNO2, CAS 1486485-42-0
1-(4-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine
CAS 1486485-42-0C17H25BFNO2
2-Methyl-1-{[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}pyrrolidine chemical structure, C18H28BNO2, CAS 1486485-46-4
2-Methyl-1-{[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}pyrrolidine
CAS 1486485-46-4C18H28BNO2
4-Fluoro-3-(pyrrolidinomethyl)phenylboronic acid pinacol ester chemical structure, C17H25BFNO2, CAS 2377607-32-2
4-Fluoro-3-(pyrrolidinomethyl)phenylboronic acid pinacol ester
CAS 2377607-32-2C17H25BFNO2
1-(3-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine chemical structure, C17H25BFNO2, CAS 2246835-35-6
1-(3-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine
CAS 2246835-35-6C17H25BFNO2
1-(1-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethyl)pyrrolidine chemical structure, C18H28BNO2, CAS 1362243-51-3
1-(1-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethyl)pyrrolidine
CAS 1362243-51-3C18H28BNO2
1-{[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}pyrrolidin-3-amine chemical structure, C17H27BN2O2, CAS 2246534-30-3
1-{[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}pyrrolidin-3-amine
CAS 2246534-30-3C17H27BN2O2
3-[[3-(Dimethylamino)-1-pyrrolidinyl]methyl]phenylboronic Acid Pinacol Ester chemical structure, C19H31BN2O2, CAS 2088249-36-7
3-[[3-(Dimethylamino)-1-pyrrolidinyl]methyl]phenylboronic Acid Pinacol Ester
CAS 2088249-36-7C19H31BN2O2
3,3-Difluoro-1-(2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine chemical structure, C18H26BF2NO2, CAS 2246350-56-9
3,3-Difluoro-1-(2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)pyrrolidine
CAS 2246350-56-9C18H26BF2NO2