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Murcko scaffold

Ring system with 3 rings and 17 atoms

132 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
132
With full pages
5
Scaffold SMILES

c1cc(N2CCNCC2)ccc1B1OCCO1

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(N2CCNCC2)ccc1B1OCCO1

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 48 of 132 chemicals

4-(4-tert-Butoxycarbonylpiperazinyl)phenylboronic acid, pinacol ester chemical structure, C21H33BN2O4, CAS 470478-90-1
4-(4-tert-Butoxycarbonylpiperazinyl)phenylboronic acid, pinacol ester
CAS 470478-90-1C21H33BN2O4
1-Isopropyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine chemical structure, C19H31BN2O2, CAS 1073354-18-3
1-Isopropyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine
CAS 1073354-18-3C19H31BN2O2
1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine chemical structure, C16H25BN2O2, CAS 912369-50-7
1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine
CAS 912369-50-7C16H25BN2O2
1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine chemical structure, C17H27BN2O2, CAS 747413-21-4
1-Methyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine
CAS 747413-21-4C17H27BN2O2
Allyl 4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate chemical structure, C20H29BN2O4, CAS 1073354-49-0
Allyl 4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate
CAS 1073354-49-0C20H29BN2O4
4-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carbaldehyde chemical structure, C17H25BN2O3, CAS 1150561-69-5
4-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carbaldehyde
CAS 1150561-69-5C17H25BN2O3
2,2,2-Trifluoro-1-(4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazin-1-yl)ethanone chemical structure, C18H24BF3N2O3, CAS 1218791-39-9
2,2,2-Trifluoro-1-(4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazin-1-yl)ethanone
CAS 1218791-39-9C18H24BF3N2O3
1-(4-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazin-1-yl)ethan-1-one chemical structure, C18H27BN2O3, CAS 1218791-38-8
1-(4-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazin-1-yl)ethan-1-one
CAS 1218791-38-8C18H27BN2O3
tert-Butyl 4-(2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate chemical structure, C21H32BN3O6, CAS 940284-94-6
tert-Butyl 4-(2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate
CAS 940284-94-6C21H32BN3O6
1-Ethyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine chemical structure, C18H29BN2O2, CAS 656257-45-3
1-Ethyl-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine
CAS 656257-45-3C18H29BN2O2
1-Methyl-4-(2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine chemical structure, C18H29BN2O2, CAS 1310704-51-8
1-Methyl-4-(2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine
CAS 1310704-51-8C18H29BN2O2
2-(4-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazin-1-yl)ethanol chemical structure, C18H29BN2O3, CAS 1089686-81-6
2-(4-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazin-1-yl)ethanol
CAS 1089686-81-6C18H29BN2O3
1-Ethyl-4-[2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine chemical structure, C19H31BN2O2, CAS 1092563-57-9
1-Ethyl-4-[2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine
CAS 1092563-57-9C19H31BN2O2
1-(2-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-4-methylpiperazine chemical structure, C18H29BN2O3, CAS 1092563-58-0
1-(2-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-4-methylpiperazine
CAS 1092563-58-0C18H29BN2O3
2-[4-(2-Hydroxyethyl)-1-piperazinyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile chemical structure, C19H28BN3O3, CAS 1105665-25-5
2-[4-(2-Hydroxyethyl)-1-piperazinyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CAS 1105665-25-5C19H28BN3O3
2-(4-Acetyl-1-piperazinyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile chemical structure, C19H26BN3O3, CAS 1105665-21-1
2-(4-Acetyl-1-piperazinyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CAS 1105665-21-1C19H26BN3O3
2-(4-Methylpiperazin-1-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile chemical structure, C18H26BN3O2, CAS 1105665-06-2
2-(4-Methylpiperazin-1-yl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile
CAS 1105665-06-2C18H26BN3O2
tert-Butyl 4-(3-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate chemical structure, C22H35BN2O5, CAS 1146950-51-7
tert-Butyl 4-(3-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate
CAS 1146950-51-7C22H35BN2O5
tert-Butyl 4-(3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate chemical structure, C21H32BFN2O4, CAS 1146950-53-9
tert-Butyl 4-(3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate
CAS 1146950-53-9C21H32BFN2O4
1-(Methylsulfonyl)-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine chemical structure, C17H27BN2O4S, CAS 1222495-59-1
1-(Methylsulfonyl)-4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine
CAS 1222495-59-1C17H27BN2O4S
tert-Butyl 4-(3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate chemical structure, C22H35BN2O4, CAS 1334659-94-7
tert-Butyl 4-(3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate
CAS 1334659-94-7C22H35BN2O4
1-(2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-4-methylpiperazine chemical structure, C17H26BFN2O2, CAS 1408088-34-5
1-(2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-4-methylpiperazine
CAS 1408088-34-5C17H26BFN2O2
2-Methoxy-1-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazin-1-yl]ethanone chemical structure, C19H29BN2O4, CAS 1415794-09-0
2-Methoxy-1-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazin-1-yl]ethanone
CAS 1415794-09-0C19H29BN2O4
2-Hydroxy-1-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazin-1-yl]ethanone chemical structure, C18H27BN2O4, CAS 1415794-10-3
2-Hydroxy-1-[4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazin-1-yl]ethanone
CAS 1415794-10-3C18H27BN2O4