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Murcko scaffold

Ring system with 4 rings and 20 atoms

8 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
20
Chemicals
8
With full pages
2
Scaffold SMILES

c1ccc(CN2CCC3CC2Cc2ccccc23)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(CN2CCC3CC2Cc2ccccc23)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

1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(phenylmethyl)-2,6-methano-3-benzazocin-8-ol chemical structure, C21H25NO, CAS 22185-52-0
1,2,3,4,5,6-Hexahydro-6,11-dimethyl-3-(phenylmethyl)-2,6-methano-3-benzazocin-8-ol
CAS 22185-52-0C21H25NO
(2alpha,6alpha,11R*)-3-Benzyl-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2,6-methano-3-benzazocin-8-ol chemical structure, C21H25NO
(2alpha,6alpha,11R*)-3-Benzyl-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2,6-methano-3-benzazocin-8-ol
C21H25NO
Deoxy-N-benzylnormetazocine chemical structure, C21H25N, CAS 147384-62-1
Deoxy-N-benzylnormetazocine
CAS 147384-62-1C21H25N
(2S,6S,11S)-3-Benzyl-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-benzo[d]azocin-8-ol chemical structure, C21H25NO, CAS 57573-46-3
(2S,6S,11S)-3-Benzyl-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-benzo[d]azocin-8-ol
CAS 57573-46-3C21H25NO
(2alpha,6alpha,11R*)-3-Benzyl-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2,6-methano-3-benzazocin-8-ol hydrobromide chemical structure, C21H26BrNO, CAS 26918-40-1
(2alpha,6alpha,11R*)-3-Benzyl-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2,6-methano-3-benzazocin-8-ol hydrobromide
CAS 26918-40-1C21H26BrNO
(1R,9S,13R)-10-Benzyl-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol chemical structure, C21H25NO
(1R,9S,13R)-10-Benzyl-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol
C21H25NO
(2alpha,6alpha,11R*)-(1)-3-Benzyl-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2,6-methano-3-benzazocin-8-ol hydrobromide chemical structure, C21H26BrNO, CAS 82597-89-5
(2alpha,6alpha,11R*)-(1)-3-Benzyl-1,2,3,4,5,6-hexahydro-6,11-dimethyl-2,6-methano-3-benzazocin-8-ol hydrobromide
CAS 82597-89-5C21H26BrNO
2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(phenylmethyl)-, (2alpha,6alpha,11R*)-(A+/-)- chemical structure, C21H25NO, CAS 58072-89-2
2,6-Methano-3-benzazocin-8-ol, 1,2,3,4,5,6-hexahydro-6,11-dimethyl-3-(phenylmethyl)-, (2alpha,6alpha,11R*)-(A+/-)-
CAS 58072-89-2C21H25NO