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Murcko scaffold

Ring system with 3 rings and 19 atoms

12 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
19
Chemicals
12
With full pages
1
Scaffold SMILES

O=C(c1ccccc1)N1CCCCc2ccccc21

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(c1ccccc1)N1CCCCc2ccccc21

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

1-(4-Methylbenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine chemical structure, C18H19NO, CAS 99293-85-3
1-(4-Methylbenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine
CAS 99293-85-3C18H19NO
1-(3,4-Dimethoxybenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine chemical structure, C19H21NO3, CAS 893777-21-4
1-(3,4-Dimethoxybenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine
CAS 893777-21-4C19H21NO3
1-(4-[N-(2-Dimethylamino-2-oxoethylcarbamoyl)aminomethyl]-3-methylbenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine chemical structure, C24H30N4O3, CAS 335154-66-0
1-(4-[N-(2-Dimethylamino-2-oxoethylcarbamoyl)aminomethyl]-3-methylbenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine
CAS 335154-66-0C24H30N4O3
1-(4-Aminobenzoyl)-2,3,4,5-tetrahydro-1H-benzazepine chemical structure, C17H18N2O, CAS 137973-03-6
1-(4-Aminobenzoyl)-2,3,4,5-tetrahydro-1H-benzazepine
CAS 137973-03-6C17H18N2O
1H-1-Benzazepine, 2,3,4,5-tetrahydro-1-(4-nitrobenzoyl)- chemical structure, C17H16N2O3, CAS 137975-23-6
1H-1-Benzazepine, 2,3,4,5-tetrahydro-1-(4-nitrobenzoyl)-
CAS 137975-23-6C17H16N2O3
(7-Chloro-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)(2-methyl-4-nitrophenyl)methanone chemical structure, C18H17ClN2O3, CAS 313673-96-0
(7-Chloro-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)(2-methyl-4-nitrophenyl)methanone
CAS 313673-96-0C18H17ClN2O3
2-Methyl-4-(2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carbonyl)benzonitrile chemical structure, C19H18N2O, CAS 335155-20-9
2-Methyl-4-(2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carbonyl)benzonitrile
CAS 335155-20-9C19H18N2O
(4-(Aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone chemical structure, C19H22N2O, CAS 736127-06-3
(4-(Aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone
CAS 736127-06-3C19H22N2O
1-[2-Methyl-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-ylcarbonyl)phenyl] methanamine chemical structure, C19H23ClN2O, CAS 335155-21-0
1-[2-Methyl-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-ylcarbonyl)phenyl] methanamine
CAS 335155-21-0C19H23ClN2O
Tolvaptan impurity 92 chemical structure, C18H18ClNO2, CAS 1580889-22-0
Tolvaptan impurity 92
CAS 1580889-22-0C18H18ClNO2
Tolvaptan metabolite DM-4131 chemical structure, C18H19ClN2O3, CAS 1809091-29-9
Tolvaptan metabolite DM-4131
CAS 1809091-29-9C18H19ClN2O3
Tolvaptan metabolite DM-4128 chemical structure, C18H19ClN2O2, CAS 1432725-24-0
Tolvaptan metabolite DM-4128
CAS 1432725-24-0C18H19ClN2O2