Murcko scaffold

Ring system with 6 rings and 38 atoms

6 chemicals on CompoundList share this ring system.

Rings: 6
Scaffold atoms: 38
Chemicals: 6
With full pages: 2

Scaffold SMILES

O=C(NC1CCN(CCCCC2c3ccccc3-c3ccccc32)CC1)c1ccccc1-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(NC1CCN(CCCCC2c3ccccc3-c3ccccc32)CC1)c1ccccc1-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

Lomitapide

CAS 182431-12-5C₃₉H₃₇F₆N₃O₂

Lomitapide impurity 2

CAS 252361-04-9C₃₇H₃₅F₃N₂O₃

Lomitapide mesylate

CAS 202914-84-9C₄₀H₄₁F₆N₃O₅S

Lomitapide metabolite M9

CAS 182430-98-4C₃₉H₃₇F₆N₃O₃

$N-(2,2,2-Trifluoroethyl)-9-[4-(4-{[4'-(trifluoromethyl)[1,1'-biphenyl]-2-carbonyl]amino}piperidin-1-yl)(2,2,3,3-~2~H_4_)butyl]-9H-fluorene-9-carboxamide chemical structure, C39H37F6N3O2, CAS 857296-42-5$

N-(2,2,2-Trifluoroethyl)-9-[4-(4-{[4'-(trifluoromethyl)[1,1'-biphenyl]-2-carbonyl]amino}piperidin-1-yl)(2,2,3,3-~2~H_4_)butyl]-9H-fluorene-9-carboxamide

CAS 857296-42-5C₃₉H₃₇F₆N₃O₂

Lomitapide-d8

CAS 2459377-96-7C₃₉H₃₇F₆N₃O₂