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Murcko scaffold

Ring system with 3 rings and 18 atoms

12 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
12
With full pages
0
Scaffold SMILES

c1ccc(OC2CCCCc3ccccc32)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(OC2CCCCc3ccccc32)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 12 of 12 chemicals

RU 25591 chemical structure, C19H22N2O3, CAS 72575-45-2
RU 25591
CAS 72575-45-2C19H22N2O3
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-5-(4-aminophenoxy)-N,N-dimethyl-, dihydrochloride, cis- chemical structure, C19H26Cl2N2O, CAS 72575-47-4
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-5-(4-aminophenoxy)-N,N-dimethyl-, dihydrochloride, cis-
CAS 72575-47-4C19H26Cl2N2O
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(4-(trifluoromethyl)phenoxy)-,hydrochloride, cis- chemical structure, C20H23ClF3NO, CAS 72575-48-5
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(4-(trifluoromethyl)phenoxy)-,hydrochloride, cis-
CAS 72575-48-5C20H23ClF3NO
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(4-nitrophenoxy)-, monohydrochloride, trans- chemical structure, C19H23ClN2O3, CAS 72575-49-6
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(4-nitrophenoxy)-, monohydrochloride, trans-
CAS 72575-49-6C19H23ClN2O3
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- chemical structure, C20H23ClF3NO, CAS 72575-50-9
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-
CAS 72575-50-9C20H23ClF3NO
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N-methyl-5-(4-(trifluoromethyl)phenoxy)-hydrochloride, cis- chemical structure, C19H21ClF3NO, CAS 72575-51-0
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N-methyl-5-(4-(trifluoromethyl)phenoxy)-hydrochloride, cis-
CAS 72575-51-0C19H21ClF3NO
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-5-(4-bromophenoxy)-N,N-dimethyl-, hydrochloride, cis- chemical structure, C19H23BrClNO, CAS 72575-52-1
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-5-(4-bromophenoxy)-N,N-dimethyl-, hydrochloride, cis-
CAS 72575-52-1C19H23BrClNO
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-nitrophenoxy)-, monohydrochloride, cis- chemical structure, C19H23ClN2O3, CAS 72575-53-2
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-nitrophenoxy)-, monohydrochloride, cis-
CAS 72575-53-2C19H23ClN2O3
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(4-nitro-3-(trifluoromethyl)phenoxy)-, cis- chemical structure, C20H21F3N2O3, CAS 72575-56-5
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(4-nitro-3-(trifluoromethyl)phenoxy)-, cis-
CAS 72575-56-5C20H21F3N2O3
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-2-chloro-N,N-dimethyl-9-(4-nitrophenoxy)-, monohydrochloride, trans- chemical structure, C19H22Cl2N2O3, CAS 72575-57-6
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-2-chloro-N,N-dimethyl-9-(4-nitrophenoxy)-, monohydrochloride, trans-
CAS 72575-57-6C19H22Cl2N2O3
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-2-chloro-N,N-dimethyl-9-(4-nitrophenoxy)-, monohydrochloride, cis- chemical structure, C19H22Cl2N2O3, CAS 72575-58-7
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-2-chloro-N,N-dimethyl-9-(4-nitrophenoxy)-, monohydrochloride, cis-
CAS 72575-58-7C19H22Cl2N2O3
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(4-nitrophenoxy)-, cis-, (E)-2-butenedioate (1:1) chemical structure, C23H26N2O7, CAS 72575-46-3
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(4-nitrophenoxy)-, cis-, (E)-2-butenedioate (1:1)
CAS 72575-46-3C23H26N2O7