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Murcko scaffold

Ring system with 4 rings and 21 atoms

7 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
21
Chemicals
7
With full pages
2
Scaffold SMILES

c1ccc2c(c1)CCNC2Cc1cccc2ccccc12

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 c1ccc2c(c1)CCNC2Cc1cccc2ccccc12

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

Ckd-712 chemical structure, C20H19NO2, CAS 626252-75-3
Ckd-712
CAS 626252-75-3C20H19NO2
(R)-1-(Naphthalen-1-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol chemical structure, C20H19NO2, CAS 626252-72-0
(R)-1-(Naphthalen-1-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol
CAS 626252-72-0C20H19NO2
YS-49 chemical structure, C20H20BrNO2, CAS 132836-11-4
YS-49
CAS 132836-11-4C20H20BrNO2
6,7-Dimethoxy-1-(alpha-naphthylmethyl)-1,2,3,4-tetrahydroisoquinoline chemical structure, C22H23NO2, CAS 108704-87-6
6,7-Dimethoxy-1-(alpha-naphthylmethyl)-1,2,3,4-tetrahydroisoquinoline
CAS 108704-87-6C22H23NO2
CKD-712 hydrobromide chemical structure, C20H20BrNO2, CAS 626252-74-2
CKD-712 hydrobromide
CAS 626252-74-2C20H20BrNO2
(R)-YS-49HBrsalt chemical structure, C20H20BrNO2, CAS 626252-73-1
(R)-YS-49HBrsalt
CAS 626252-73-1C20H20BrNO2
YS-49 monohydrate chemical structure, C20H22BrNO3, CAS 3028631-24-2
YS-49 monohydrate
CAS 3028631-24-2C20H22BrNO3