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Murcko scaffold

Ring system with 2 rings and 19 atoms

94 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
19
Chemicals
94
With full pages
18
Scaffold SMILES

c1ccc(CCCCNCCc2ccccc2)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(CCCCNCCc2ccccc2)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 48 of 94 chemicals

Gallopamil chemical structure, C28H40N2O5, CAS 16662-47-8
Gallopamil
CAS 16662-47-8C28H40N2O5
Verapamil chemical structure, C27H38N2O4, CAS 52-53-9
Verapamil
CAS 52-53-9C27H38N2O4
Anipamil chemical structure, C34H52N2O2, CAS 83200-10-6
Anipamil
CAS 83200-10-6C34H52N2O2
Arbutamine chemical structure, C18H23NO4, CAS 128470-16-6
Arbutamine
CAS 128470-16-6C18H23NO4
Verapamil hydrochloride chemical structure, C27H39ClN2O4, CAS 152-11-4
Verapamil hydrochloride
CAS 152-11-4C27H39ClN2O4
Ronipamil chemical structure, C32H48N2, CAS 85247-77-4
Ronipamil
CAS 85247-77-4C32H48N2
Dexverapamil chemical structure, C27H38N2O4, CAS 38321-02-7
Dexverapamil
CAS 38321-02-7C27H38N2O4
Devapamil chemical structure, C26H36N2O3, CAS 92302-55-1
Devapamil
CAS 92302-55-1C26H36N2O3
Levemopamil chemical structure, C23H30N2, CAS 101238-51-1
Levemopamil
CAS 101238-51-1C23H30N2
(S)-Verapamil chemical structure, C27H38N2O4, CAS 36622-29-4
(S)-Verapamil
CAS 36622-29-4C27H38N2O4
Norverapamil chemical structure, C26H36N2O4, CAS 67018-85-3
Norverapamil
CAS 67018-85-3C26H36N2O4
(AlphaS)-3,4-dimethoxy-alpha-(3-((2-(3-methoxyphenyl)ethyl)methylamino)propyl)-alpha-(1-methylethyl)benzeneacetonitrile chemical structure, C26H36N2O3, CAS 93468-87-2
(AlphaS)-3,4-dimethoxy-alpha-(3-((2-(3-methoxyphenyl)ethyl)methylamino)propyl)-alpha-(1-methylethyl)benzeneacetonitrile
CAS 93468-87-2C26H36N2O3
Gallopamil hydrochloride chemical structure, C28H41ClN2O5, CAS 16662-46-7
Gallopamil hydrochloride
CAS 16662-46-7C28H41ClN2O5
5-((3,4-Dimethoxyphenethyl)methylamino)-2-(3,4-dimethoxyphenyl)-2-isopropylpentyl isothiocyanate chemical structure, C28H40N2O4S, CAS 102852-53-9
5-((3,4-Dimethoxyphenethyl)methylamino)-2-(3,4-dimethoxyphenyl)-2-isopropylpentyl isothiocyanate
CAS 102852-53-9C28H40N2O4S
Norgallopamil chemical structure, C27H38N2O5, CAS 108050-23-3
Norgallopamil
CAS 108050-23-3C27H38N2O5
RefChem:130463 chemical structure, C29H43N2O5+, CAS 82736-00-3
RefChem:130463
CAS 82736-00-3C29H43N2O5+
Norverapamil hydrochloride chemical structure, C26H37ClN2O4, CAS 67812-42-4
Norverapamil hydrochloride
CAS 67812-42-4C26H37ClN2O4
N-Desmethylverapamil chemical structure, C26H36N2O4, CAS 77326-93-3
N-Desmethylverapamil
CAS 77326-93-3C26H36N2O4
Mepamil chemical structure, C26H36N2O2, CAS 117721-47-8
Mepamil
CAS 117721-47-8C26H36N2O2
RefChem:130462 chemical structure, C25H32Cl2N2O2, CAS 16740-29-7
RefChem:130462
CAS 16740-29-7C25H32Cl2N2O2
Arbutamine hydrochloride chemical structure, C18H24ClNO4, CAS 125251-66-3
Arbutamine hydrochloride
CAS 125251-66-3C18H24ClNO4
Dexverapamil hydrochloride chemical structure, C27H39ClN2O4, CAS 38176-02-2
Dexverapamil hydrochloride
CAS 38176-02-2C27H39ClN2O4
Levemopamil hydrochloride chemical structure, C23H31ClN2, CAS 101238-54-4
Levemopamil hydrochloride
CAS 101238-54-4C23H31ClN2
2-(2,6-Dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile chemical structure, C27H38N2O4, CAS 103768-76-9
2-(2,6-Dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile
CAS 103768-76-9C27H38N2O4