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Murcko scaffold

Ring system with 2 rings and 22 atoms

8 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
22
Chemicals
8
With full pages
2
Scaffold SMILES

O=C(CCCCCNCCc1cnc[nH]1)Nc1ccccc1

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(CCCCCNCCc1cnc[nH]1)Nc1ccccc1

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

6-((2-(4-Imidazolyl)ethyl)amino)heptanoic acid 4-toluidide chemical structure, C19H28N4O, CAS 103827-15-2
6-((2-(4-Imidazolyl)ethyl)amino)heptanoic acid 4-toluidide
CAS 103827-15-2C19H28N4O
6-((2-(1H-Imidazol-5-yl)ethyl)amino)-N-(4-(trifluoromethyl)phenyl)heptanamide chemical structure, C19H25F3N4O, CAS 103827-16-3
6-((2-(1H-Imidazol-5-yl)ethyl)amino)-N-(4-(trifluoromethyl)phenyl)heptanamide
CAS 103827-16-3C19H25F3N4O
Histamine trifluoromethyl toluidide, (S)- chemical structure, C19H25F3N4O, CAS 2650867-30-2
Histamine trifluoromethyl toluidide, (S)-
CAS 2650867-30-2C19H25F3N4O
6-((2-(1H-Imidazol-5-yl)ethyl)amino)-N-(4-(trifluoromethyl)phenyl)heptanamide maleate chemical structure, C23H29F3N4O5
6-((2-(1H-Imidazol-5-yl)ethyl)amino)-N-(4-(trifluoromethyl)phenyl)heptanamide maleate
C23H29F3N4O5
HTMT dimaleate chemical structure, C27H33F3N4O9, CAS 195867-54-0
HTMT dimaleate
CAS 195867-54-0C27H33F3N4O9
HTMT (dimaleate) chemical structure, C27H33F3N4O9
HTMT (dimaleate)
C27H33F3N4O9
HTMT (dimaleate) chemical structure, C27H33F3N4O9
HTMT (dimaleate)
C27H33F3N4O9
Histamine trifluoromethyl toluidide, (R)- chemical structure, C19H25F3N4O, CAS 129179-06-2
Histamine trifluoromethyl toluidide, (R)-
CAS 129179-06-2C19H25F3N4O