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Murcko scaffold

Ring system with 3 rings and 19 atoms

7 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 19
Chemicals: 7
With full pages: 3

Scaffold SMILES

C(#Cc1ccc(B2OCCO2)cc1)c1ccccc1

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(#Cc1ccc(B2OCCO2)cc1)c1ccccc1

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 7 of 7 chemicals

2-[3,5-Dimethyl-4-(phenylethynyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane chemical structure, C22H25BO2, CAS 942069-63-8

2-[3,5-Dimethyl-4-(phenylethynyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS 942069-63-8C₂₂H₂₅BO₂

2-(4-(2-(4-Chlorophenyl)ethynyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane chemical structure, C20H20BClO2, CAS 1315281-10-7

2-(4-(2-(4-Chlorophenyl)ethynyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS 1315281-10-7C₂₀H₂₀BClO₂

4,4,5,5-Tetramethyl-2-(4-phenylethynyl-phenyl)-[1,3,2]dioxaborolane chemical structure, C20H21BO2, CAS 1190376-20-5

4,4,5,5-Tetramethyl-2-(4-phenylethynyl-phenyl)-[1,3,2]dioxaborolane

CAS 1190376-20-5C₂₀H₂₁BO₂

Methyl 4-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethynyl)benzoate chemical structure, C22H23BO4, CAS 1448637-05-5

Methyl 4-((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethynyl)benzoate

CAS 1448637-05-5C₂₂H₂₃BO₄

2-(4-(4-Methoxy-phenylethynyl)-phenyl)-4,4,5,5-tetramethyl-(1,3,2)dioxaborolane chemical structure, C21H23BO3, CAS 1190376-24-9

2-(4-(4-Methoxy-phenylethynyl)-phenyl)-4,4,5,5-tetramethyl-(1,3,2)dioxaborolane

CAS 1190376-24-9C₂₁H₂₃BO₃

4-[2-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethynyl]benzaldehyde chemical structure, C21H21BO3, CAS 1244016-76-9

4-[2-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethynyl]benzaldehyde

CAS 1244016-76-9C₂₁H₂₁BO₃

3-[2-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethynyl]benzaldehyde chemical structure, C21H21BO3, CAS 1244018-89-0

3-[2-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethynyl]benzaldehyde

CAS 1244018-89-0C₂₁H₂₁BO₃