Murcko scaffold
Ring system with 6 rings and 43 atoms
4 chemicals on CompoundList share this ring system.
- Rings
- 6
- Scaffold atoms
- 43
- Chemicals
- 4
- With full pages
- 0
Scaffold SMILES
c1cc(CCC2CCNC2)cc(CN(Cc2cccc(CCC3CCNC3)c2)Cc2cccc(CCC3CCNC3)c2)c1
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.
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 4 of 4 chemicals
Muvalaplin
CAS 2565656-70-2C42H54N4O6
![3-Pyrrolidineacetic acid, alpha,alpha',alpha''-[nitrilotris(methylene-3,1-phenylenemethylene)]tris[1-[(1,1-dimethylethoxy)carbonyl]-, 3,3',3''-tris(1,1-dimethylethyl) ester, (alphaS,alpha'S,alpha''S,3R,3'R,3''R)- chemical structure, C69H102N4O12, CAS 2565657-89-6](/s/GBFBOOSDXKLCPU-VICXIOLRSA-N.svg)
3-Pyrrolidineacetic acid, alpha,alpha',alpha''-[nitrilotris(methylene-3,1-phenylenemethylene)]tris[1-[(1,1-dimethylethoxy)carbonyl]-, 3,3',3''-tris(1,1-dimethylethyl) ester, (alphaS,alpha'S,alpha''S,3R,3'R,3''R)-
CAS 2565657-89-6C69H102N4O12
(2S,2'S,2''S)-3,3',3''-((Nitrilotris(methylene))tris(benzene-3,1-diyl))tris(2-((R)-pyrrolidin-3-yl)propanoic acid) tetrahydrochloride
CAS 2565656-71-3C42H58Cl4N4O6
Orb3028880
CAS 2566425-77-0C45H61ClN4O6