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Murcko scaffold

Ring system with 3 rings and 18 atoms

5 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
5
With full pages
0
Scaffold SMILES

c1ccc(NCC2CNc3ncncc3N2)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(NCC2CNc3ncncc3N2)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 5 of 5 chemicals

Tetrahydroxyaminopterin chemical structure, C19H24N8O5, CAS 14231-41-5
Tetrahydroxyaminopterin
CAS 14231-41-5C19H24N8O5
Tetrahydromethotrexate chemical structure, C20H26N8O5, CAS 4299-28-9
Tetrahydromethotrexate
CAS 4299-28-9C20H26N8O5
Tetrahydro-3',5'-dichloromethotrexate chemical structure, C20H24Cl2N8O5, CAS 17700-70-8
Tetrahydro-3',5'-dichloromethotrexate
CAS 17700-70-8C20H24Cl2N8O5
Calcium levofolinate chemical structure, C20H21CaN7O7
Calcium levofolinate
C20H21CaN7O7
Calcium, (2S)-2-[[4-[(2-amino-5-methyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioate chemical structure, C20H23CaN7O6
Calcium, (2S)-2-[[4-[(2-amino-5-methyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioate
C20H23CaN7O6