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Murcko scaffold

Ring system with 2 rings and 14 atoms

12 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
14
Chemicals
12
With full pages
5
Scaffold SMILES

c1ccc(NC2=NCCCCC2)cc1

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 c1ccc(NC2=NCCCCC2)cc1

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

N-(4-Chlorophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine chemical structure, C12H15ClN2, CAS 34616-99-4
N-(4-Chlorophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CAS 34616-99-4C12H15ClN2
1-(4-Bromophenyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)thiourea chemical structure, C13H16BrN3S, CAS 306280-57-9
1-(4-Bromophenyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)thiourea
CAS 306280-57-9C13H16BrN3S
N-(3-Methoxyphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine chemical structure, C13H18N2O, CAS 305341-58-6
N-(3-Methoxyphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CAS 305341-58-6C13H18N2O
N-(2,5-Difluorophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine chemical structure, C12H14F2N2, CAS 380344-30-9
N-(2,5-Difluorophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CAS 380344-30-9C12H14F2N2
4-Chloro-N,N-diethyl-3-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)benzenesulfonamide chemical structure, C16H24ClN3O2S, CAS 325720-97-6
4-Chloro-N,N-diethyl-3-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)benzenesulfonamide
CAS 325720-97-6C16H24ClN3O2S
2H-Azepin-7-amine, N-(2,4-difluorophenyl)-3,4,5,6-tetrahydro- chemical structure, C12H14F2N2, CAS 325720-89-6
2H-Azepin-7-amine, N-(2,4-difluorophenyl)-3,4,5,6-tetrahydro-
CAS 325720-89-6C12H14F2N2
N-(2-Methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine chemical structure, C13H18N2, CAS 802607-27-8
N-(2-Methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CAS 802607-27-8C13H18N2
N-(2,4-Dichlorophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine chemical structure, C12H14Cl2N2, CAS 67997-80-2
N-(2,4-Dichlorophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CAS 67997-80-2C12H14Cl2N2
2-(4-Methoxyanilino)azacyclohept-1-ene hydrochloride chemical structure, C13H19ClN2O, CAS 16595-45-2
2-(4-Methoxyanilino)azacyclohept-1-ene hydrochloride
CAS 16595-45-2C13H19ClN2O
N-(4-Bromophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrobromide chemical structure, C12H16Br2N2, CAS 479349-67-2
N-(4-Bromophenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine hydrobromide
CAS 479349-67-2C12H16Br2N2
N-(4-Propylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine chemical structure, C15H22N2, CAS 1508146-82-4
N-(4-Propylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CAS 1508146-82-4C15H22N2
Ethyl 2-[(hexahydro-1-methyl-2H-azepin-2-ylidene)amino]benzoate chemical structure, C16H22N2O2, CAS 53114-58-2
Ethyl 2-[(hexahydro-1-methyl-2H-azepin-2-ylidene)amino]benzoate
CAS 53114-58-2C16H22N2O2