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Murcko scaffold

Ring system with 3 rings and 27 atoms

8 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
27
Chemicals
8
With full pages
0
Scaffold SMILES

O=C(NCC(=O)N1CCCC1C(=O)NCCc1ccccc1)C1CCCN1

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 O=C(NCC(=O)N1CCCC1C(=O)NCCc1ccccc1)C1CCCN1

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

Valyl-glutamyl-prolyl-isoleucyl-prolyl-tyrosine chemical structure, C35H52N6O10, CAS 94773-24-7
Valyl-glutamyl-prolyl-isoleucyl-prolyl-tyrosine
CAS 94773-24-7C35H52N6O10
Acetyl-prolyl-alanyl-prolyl-tyrosylamide chemical structure, C24H33N5O6, CAS 60240-19-9
Acetyl-prolyl-alanyl-prolyl-tyrosylamide
CAS 60240-19-9C24H33N5O6
1-Acetyl-L-prolyl-L-alanyl-L-prolyl-L-phenylalanyl-L-alanyl-L-alaninamide chemical structure, C30H43N7O7, CAS 60091-22-7
1-Acetyl-L-prolyl-L-alanyl-L-prolyl-L-phenylalanyl-L-alanyl-L-alaninamide
CAS 60091-22-7C30H43N7O7
1-Acetyl-L-prolyl-L-alanyl-L-prolyl-L-phenylalanyl-L-alaninamide chemical structure, C27H38N6O6, CAS 60240-21-3
1-Acetyl-L-prolyl-L-alanyl-L-prolyl-L-phenylalanyl-L-alaninamide
CAS 60240-21-3C27H38N6O6
1-Acetyl-L-prolyl-L-alanyl-L-prolyl-L-phenylalanylglycinamide chemical structure, C26H36N6O6, CAS 60240-20-2
1-Acetyl-L-prolyl-L-alanyl-L-prolyl-L-phenylalanylglycinamide
CAS 60240-20-2C26H36N6O6
1-Acetyl-L-prolyl-L-alanyl-L-prolyl-L-phenylalaninamide chemical structure, C24H33N5O5, CAS 60240-15-5
1-Acetyl-L-prolyl-L-alanyl-L-prolyl-L-phenylalaninamide
CAS 60240-15-5C24H33N5O5
L-Leucyl-L-prolyl-L-leucyl-L-prolyl-L-phenylalanine chemical structure, C31H47N5O6, CAS 832731-14-3
L-Leucyl-L-prolyl-L-leucyl-L-prolyl-L-phenylalanine
CAS 832731-14-3C31H47N5O6
Iri-514 chemical structure, C31H45N9O8, CAS 147489-65-4
Iri-514
CAS 147489-65-4C31H45N9O8