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Murcko scaffold

Ring system with 4 rings and 20 atoms

5 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
20
Chemicals
5
With full pages
0
Scaffold SMILES

C1=CC2(CCC1)c1ccccc1C=Cc1ccccc12

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 C1=CC2(CCC1)c1ccccc1C=Cc1ccccc12

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 5 of 5 chemicals

Spiro(5H-dibenzo(a,d)cycloheptene-5,1'-cyclohex-2'-en)-4'-amine, 3-chloro-N,N-dimethyl-, hydrochloride chemical structure, C22H23Cl2N, CAS 41659-20-5
Spiro(5H-dibenzo(a,d)cycloheptene-5,1'-cyclohex-2'-en)-4'-amine, 3-chloro-N,N-dimethyl-, hydrochloride
CAS 41659-20-5C22H23Cl2N
Spiro(2-cyclohexene-1,5'-(5H)dibenzo(a,d)cyclohepten)-4-amine, 3'-chloro-N,N-dimethyl-, (1S-cis)- chemical structure, C22H22ClN, CAS 69319-52-4
Spiro(2-cyclohexene-1,5'-(5H)dibenzo(a,d)cyclohepten)-4-amine, 3'-chloro-N,N-dimethyl-, (1S-cis)-
CAS 69319-52-4C22H22ClN
Cpg 264 chemical structure, C21H22ClN, CAS 41695-45-8
Cpg 264
CAS 41695-45-8C21H22ClN
Cpg 146 chemical structure, C22H24ClN, CAS 51360-06-6
Cpg 146
CAS 51360-06-6C22H24ClN
Spiro(5H-dibenzo(a,d)cycloheptene-5,1'-cyclohex-2'-en)-4'-amine, (Z)-2-butenedioate (1:1) chemical structure, C24H23NO4, CAS 51359-93-4
Spiro(5H-dibenzo(a,d)cycloheptene-5,1'-cyclohex-2'-en)-4'-amine, (Z)-2-butenedioate (1:1)
CAS 51359-93-4C24H23NO4