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Murcko scaffold

Ring system with 3 rings and 25 atoms

6 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
25
Chemicals
6
With full pages
2
Scaffold SMILES

O=C(NCCc1ccccc1)C1CCCN1S(=O)(=O)c1ccccc1

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(NCCc1ccccc1)C1CCCN1S(=O)(=O)c1ccccc1

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 6 of 6 chemicals

1-(Benzenesulfonyl)-N-[2-(2-fluorophenyl)ethyl]pyrrolidine-2-carboxamide chemical structure, C19H21FN2O3S, CAS 475042-53-6
1-(Benzenesulfonyl)-N-[2-(2-fluorophenyl)ethyl]pyrrolidine-2-carboxamide
CAS 475042-53-6C19H21FN2O3S
L-Tyrosine, 1-(phenylsulfonyl)-L-prolyl- chemical structure, C20H22N2O6S, CAS 352275-26-4
L-Tyrosine, 1-(phenylsulfonyl)-L-prolyl-
CAS 352275-26-4C20H22N2O6S
(2S)-2-[[(2S)-1-(3,5-Dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid chemical structure, C21H22Cl2N2O5S, CAS 217452-76-1
(2S)-2-[[(2S)-1-(3,5-Dichlorophenyl)sulfonyl-2-methylpyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid
CAS 217452-76-1C21H22Cl2N2O5S
(S)-3-(4-Aminophenyl)-2-((S)-1-tosylpyrrolidine-2-carboxamido)propanoic acid chemical structure, C21H25N3O5S, CAS 220149-81-5
(S)-3-(4-Aminophenyl)-2-((S)-1-tosylpyrrolidine-2-carboxamido)propanoic acid
CAS 220149-81-5C21H25N3O5S
alphavbeta1 integrin-IN-1 chemical structure, C26H34N6O6S, CAS 1689540-62-2
alphavbeta1 integrin-IN-1
CAS 1689540-62-2C26H34N6O6S
1-(Benzenesulfonyl)-L-prolyl-4-(4-carbamimidamidobutanamido)-L-phenylalanine chemical structure, C25H32N6O6S, CAS 1689540-60-0
1-(Benzenesulfonyl)-L-prolyl-4-(4-carbamimidamidobutanamido)-L-phenylalanine
CAS 1689540-60-0C25H32N6O6S