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Murcko scaffold

Ring system with 4 rings and 24 atoms

8 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
24
Chemicals
8
With full pages
2
Scaffold SMILES

c1ccc(C2CCC(N3CCC(c4ccccc4)CC3)CC2)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 scaffold
Murcko scaffold c1ccc(C2CCC(N3CCC(c4ccccc4)CC3)CC2)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 8 of 8 chemicals

Levocabastine hydrochloride chemical structure, C26H30ClFN2O2, CAS 79547-78-7
Levocabastine hydrochloride
CAS 79547-78-7C26H30ClFN2O2
Levocabastine chemical structure, C26H29FN2O2, CAS 79516-68-0
Levocabastine
CAS 79516-68-0C26H29FN2O2
1-(4-Cyano-4-(4-fluorophenyl)cyclohexyl)-3-methyl-4-phenylpiperidine-4-carboxylic acid monohydrochloride chemical structure, C26H30ClFN2O2, CAS 80185-65-5
1-(4-Cyano-4-(4-fluorophenyl)cyclohexyl)-3-methyl-4-phenylpiperidine-4-carboxylic acid monohydrochloride
CAS 80185-65-5C26H30ClFN2O2
1-[4-Cyano-4-(4-fluorophenyl)cyclohexyl]-4-phenyl-4-piperidinecarboxylic acid chemical structure, C25H27FN2O2, CAS 80139-90-8
1-[4-Cyano-4-(4-fluorophenyl)cyclohexyl]-4-phenyl-4-piperidinecarboxylic acid
CAS 80139-90-8C25H27FN2O2
(3S,4S)-Levocabastine chemical structure, C26H29FN2O2, CAS 105452-52-6
(3S,4S)-Levocabastine
CAS 105452-52-6C26H29FN2O2
Desmethyl rac-Cabastine Hydrochloride chemical structure, C25H28ClFN2O2, CAS 80139-91-9
Desmethyl rac-Cabastine Hydrochloride
CAS 80139-91-9C25H28ClFN2O2
(1)-(1-(Cis),3alpha,4beta)-1-(4-cyano-4-(4-fluorophenyl)cyclohexyl)-3-methyl-4-phenylpiperidine-4-carboxylic acid monohydrochloride chemical structure, C26H30ClFN2O2, CAS 79516-67-9
(1)-(1-(Cis),3alpha,4beta)-1-(4-cyano-4-(4-fluorophenyl)cyclohexyl)-3-methyl-4-phenylpiperidine-4-carboxylic acid monohydrochloride
CAS 79516-67-9C26H30ClFN2O2
Desfluoro cabastine chemical structure, C26H30N2O2, CAS 1348822-76-3
Desfluoro cabastine
CAS 1348822-76-3C26H30N2O2