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Murcko scaffold

Ring system with 3 rings and 23 atoms

12 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
23
Chemicals
12
With full pages
1
Scaffold SMILES

O=C(NC(Cc1ccccc1)C(=O)N1CCCC1)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(NC(Cc1ccccc1)C(=O)N1CCCC1)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 12 of 12 chemicals

beta-Casomorphin, des-Tyr- chemical structure, C21H28N4O5, CAS 82289-41-6
beta-Casomorphin, des-Tyr-
CAS 82289-41-6C21H28N4O5
L-Glutamine, L-valyl-L-prolyl-L-tyrosyl-L-prolyl- chemical structure, C29H42N6O8, CAS 895124-56-8
L-Glutamine, L-valyl-L-prolyl-L-tyrosyl-L-prolyl-
CAS 895124-56-8C29H42N6O8
L-Arginine, L-leucyl-L-prolyl-L-tyrosyl-L-prolyl- chemical structure, C31H48N8O7, CAS 271788-87-5
L-Arginine, L-leucyl-L-prolyl-L-tyrosyl-L-prolyl-
CAS 271788-87-5C31H48N8O7
L-Proline, L-prolyl-L-phenylalanyl- chemical structure, C19H25N3O4, CAS 58705-25-2
L-Proline, L-prolyl-L-phenylalanyl-
CAS 58705-25-2C19H25N3O4
L-Valine, glycyl-L-prolyl-L-phenylalanyl-L-prolyl-L-isoleucyl-L-isoleucyl- chemical structure, C38H59N7O8, CAS 75922-52-0
L-Valine, glycyl-L-prolyl-L-phenylalanyl-L-prolyl-L-isoleucyl-L-isoleucyl-
CAS 75922-52-0C38H59N7O8
1-(Carboxymethyl)-L-prolyl-L-phenylalanyl-L-proline chemical structure, C21H27N3O6, CAS 87297-17-4
1-(Carboxymethyl)-L-prolyl-L-phenylalanyl-L-proline
CAS 87297-17-4C21H27N3O6
L-Valyl-L-prolyl-L-tyrosyl-L-prolyl-L-glutaminyl-N~5~-(diaminomethylidene)-L-ornithine chemical structure, C35H54N10O9, CAS 918424-36-9
L-Valyl-L-prolyl-L-tyrosyl-L-prolyl-L-glutaminyl-N~5~-(diaminomethylidene)-L-ornithine
CAS 918424-36-9C35H54N10O9
L-Valyl-L-alanyl-L-prolyl-L-phenylalanyl-L-prolyl-L-glutamic acid chemical structure, C32H46N6O9, CAS 922713-37-9
L-Valyl-L-alanyl-L-prolyl-L-phenylalanyl-L-prolyl-L-glutamic acid
CAS 922713-37-9C32H46N6O9
L-Leucyl-L-prolyl-L-tyrosyl-L-proline chemical structure, C25H36N4O6, CAS 875271-99-1
L-Leucyl-L-prolyl-L-tyrosyl-L-proline
CAS 875271-99-1C25H36N4O6
L-Glutaminyl-L-glutaminyl-L-prolyl-L-phenylalanyl-L-proline chemical structure, C29H41N7O8, CAS 417708-30-6
L-Glutaminyl-L-glutaminyl-L-prolyl-L-phenylalanyl-L-proline
CAS 417708-30-6C29H41N7O8
H-Pro-Phe-Pro-Ile-Ile-Val-OH chemical structure, C36H56N6O7, CAS 99909-34-9
H-Pro-Phe-Pro-Ile-Ile-Val-OH
CAS 99909-34-9C36H56N6O7
a-Substance IB chemical structure, C33H51N9O7, CAS 60407-48-9
a-Substance IB
CAS 60407-48-9C33H51N9O7