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Murcko scaffold

Ring system with 4 rings and 30 atoms

8 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
30
Chemicals
8
With full pages
3
Scaffold SMILES

O=C(Cc1ccccc1)NCC(=O)NC1C(=O)Nc2ccccc2-c2ccccc21

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(Cc1ccccc1)NCC(=O)NC1C(=O)Nc2ccccc2-c2ccccc21

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

2-[[2-(3,5-Difluorophenyl)-2-hydroxyacetyl]amino]-N-(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)propanamide chemical structure, C26H23F2N3O4, CAS 1103516-01-3
2-[[2-(3,5-Difluorophenyl)-2-hydroxyacetyl]amino]-N-(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)propanamide
CAS 1103516-01-3C26H23F2N3O4
(AlphaS)-N-((1S)-2-(((7S)-6,7-dihydro-5-methyl-6-oxo-5H-dibenz(b,d)azepin-7-yl)amino)-1-methyl-2-oxoethyl)-3,5-difluoro-alpha-hydroxybenzeneacetamide chemical structure, C26H23F2N3O4, CAS 209984-57-6
(AlphaS)-N-((1S)-2-(((7S)-6,7-dihydro-5-methyl-6-oxo-5H-dibenz(b,d)azepin-7-yl)amino)-1-methyl-2-oxoethyl)-3,5-difluoro-alpha-hydroxybenzeneacetamide
CAS 209984-57-6C26H23F2N3O4
(S)-2-(2-(3,5-Difluorophenyl)acetamido)-N-((S)-5-methyl-6-oxo-6,7-dihydro-5H-dibenzo[b,d]azepin-7-yl)propanamide chemical structure, C26H23F2N3O3, CAS 209984-56-5
(S)-2-(2-(3,5-Difluorophenyl)acetamido)-N-((S)-5-methyl-6-oxo-6,7-dihydro-5H-dibenzo[b,d]azepin-7-yl)propanamide
CAS 209984-56-5C26H23F2N3O3
Deshydroxy LY411575 chemical structure, C26H23F2N3O3, CAS 683277-95-4
Deshydroxy LY411575
CAS 683277-95-4C26H23F2N3O3
(2S)-2-((S)-2-(3,5-Difluorophenyl)-2-hydroxyacetamido)-N-(5-methyl-6-oxo-6,7-dihydro-5H-dibenzo[b,d]azepin-7-yl)propanamide chemical structure, C26H23F2N3O4, CAS 1103722-91-3
(2S)-2-((S)-2-(3,5-Difluorophenyl)-2-hydroxyacetamido)-N-(5-methyl-6-oxo-6,7-dihydro-5H-dibenzo[b,d]azepin-7-yl)propanamide
CAS 1103722-91-3C26H23F2N3O4
LY-411575 isomer 1 chemical structure, C26H23F2N3O4, CAS 209984-58-7
LY-411575 isomer 1
CAS 209984-58-7C26H23F2N3O4
LY-411575 (isomer 2) chemical structure, C26H23F2N3O4, CAS 2070009-70-8
LY-411575 (isomer 2)
CAS 2070009-70-8C26H23F2N3O4
LY-411575 (isomer 3) chemical structure, C26H23F2N3O4, CAS 2070009-28-6
LY-411575 (isomer 3)
CAS 2070009-28-6C26H23F2N3O4