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Murcko scaffold

Phenylisochroman scaffold

33 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
16
Chemicals
33
With full pages
2
Scaffold SMILES

c1ccc(C2OCCc3ccccc32)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 scaffoldOpen the Phenylisochroman page
Murcko scaffold c1ccc(C2OCCc3ccccc32)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 33 of 33 chemicals

1-Isochromanpropylamine, N,N-dimethyl-1-phenyl-, hydrochloride chemical structure, C20H26ClNO, CAS 10565-82-9
1-Isochromanpropylamine, N,N-dimethyl-1-phenyl-, hydrochloride
CAS 10565-82-9C20H26ClNO
1-Isochromanpropylamine, N-methyl-1-phenyl-, hydrochloride chemical structure, C19H24ClNO, CAS 10565-83-0
1-Isochromanpropylamine, N-methyl-1-phenyl-, hydrochloride
CAS 10565-83-0C19H24ClNO
6,7-Dimethoxy-1-phenyl-3,4-dihydro-1H-isochromene chemical structure, C17H18O3, CAS 22506-58-7
6,7-Dimethoxy-1-phenyl-3,4-dihydro-1H-isochromene
CAS 22506-58-7C17H18O3
6,7-Dimethoxy-1-(4-nitrophenyl)-3,4-dihydro-1H-isochromene chemical structure, C17H17NO5, CAS 92774-40-8
6,7-Dimethoxy-1-(4-nitrophenyl)-3,4-dihydro-1H-isochromene
CAS 92774-40-8C17H17NO5
1-(4-Fluorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isochromene chemical structure, C17H17FO3, CAS 893775-86-5
1-(4-Fluorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isochromene
CAS 893775-86-5C17H17FO3
6,7-Dimethoxy-1-(4-methoxyphenyl)-3,4-dihydro-1H-isochromene chemical structure, C18H20O4, CAS 83640-83-9
6,7-Dimethoxy-1-(4-methoxyphenyl)-3,4-dihydro-1H-isochromene
CAS 83640-83-9C18H20O4
1-(4-Bromophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isochromene chemical structure, C17H17BrO3, CAS 187940-01-8
1-(4-Bromophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isochromene
CAS 187940-01-8C17H17BrO3
1-(3,4-Dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isochromene chemical structure, C19H22O5, CAS 861144-96-9
1-(3,4-Dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydro-1H-isochromene
CAS 861144-96-9C19H22O5
Methyl 4-(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)benzoate chemical structure, C19H20O5, CAS 893777-91-8
Methyl 4-(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)benzoate
CAS 893777-91-8C19H20O5
6,7-Dimethoxy-1-(2-nitrophenyl)-3,4-dihydro-1H-isochromene chemical structure, C17H17NO5, CAS 92774-38-4
6,7-Dimethoxy-1-(2-nitrophenyl)-3,4-dihydro-1H-isochromene
CAS 92774-38-4C17H17NO5
RefChem:381544 chemical structure, C17H17NO5, CAS 92774-39-5
RefChem:381544
CAS 92774-39-5C17H17NO5
Fenisorex chemical structure, C16H16FNO, CAS 34887-52-0
Fenisorex
CAS 34887-52-0C16H16FNO
1H-2-Benzopyran-6,7-diol, 3,4-dihydro-1-(4-hydroxy-3-methoxyphenyl)- chemical structure, C16H16O5, CAS 385444-85-9
1H-2-Benzopyran-6,7-diol, 3,4-dihydro-1-(4-hydroxy-3-methoxyphenyl)-
CAS 385444-85-9C16H16O5
1H-2-Benzopyran-1-ol, 3,4-dihydro-4,4,6,7,8-pentamethyl-1-phenyl- chemical structure, C20H24O2, CAS 848846-31-1
1H-2-Benzopyran-1-ol, 3,4-dihydro-4,4,6,7,8-pentamethyl-1-phenyl-
CAS 848846-31-1C20H24O2
Phenylisochroman chemical structure, C15H14O, CAS 2292-59-3
Phenylisochroman
CAS 2292-59-3C15H14O
1H-2-Benzopyran,1-(4-chlorophenyl)-3,4-dihydro- chemical structure, C15H13ClO, CAS 1962-27-2
1H-2-Benzopyran,1-(4-chlorophenyl)-3,4-dihydro-
CAS 1962-27-2C15H13ClO
1H-2-Benzopyran,3,4-dihydro-1-(4-methoxyphenyl)- chemical structure, C16H16O2, CAS 2292-60-6
1H-2-Benzopyran,3,4-dihydro-1-(4-methoxyphenyl)-
CAS 2292-60-6C16H16O2
1H-2-Benzopyran, 1-(4-chlorophenyl)-3,4-dihydro-6,7-dimethoxy- chemical structure, C17H17ClO3, CAS 63932-13-8
1H-2-Benzopyran, 1-(4-chlorophenyl)-3,4-dihydro-6,7-dimethoxy-
CAS 63932-13-8C17H17ClO3
4-(3,4-Dihydro-1H-2-benzopyran-1-yl)aniline chemical structure, C15H15NO, CAS 82746-10-9
4-(3,4-Dihydro-1H-2-benzopyran-1-yl)aniline
CAS 82746-10-9C15H15NO
6,7-Dimethoxy-1-(3-methoxyphenyl)-3,4-dihydro-1H-2-benzopyran chemical structure, C18H20O4, CAS 92774-37-3
6,7-Dimethoxy-1-(3-methoxyphenyl)-3,4-dihydro-1H-2-benzopyran
CAS 92774-37-3C18H20O4
1-(4-Bromophenyl)-6,7-dimethoxy-3-methylisochroman chemical structure, C18H19BrO3, CAS 1564270-40-1
1-(4-Bromophenyl)-6,7-dimethoxy-3-methylisochroman
CAS 1564270-40-1C18H19BrO3
1-Phenylisochroman-3-ol chemical structure, C15H14O2, CAS 42710-40-7
1-Phenylisochroman-3-ol
CAS 42710-40-7C15H14O2
1H-2-Benzopyran-3-carboxylic acid, 3,4-dihydro-1-phenyl-, (1S-cis)- chemical structure, C16H14O3, CAS 136781-47-0
1H-2-Benzopyran-3-carboxylic acid, 3,4-dihydro-1-phenyl-, (1S-cis)-
CAS 136781-47-0C16H14O3
7-Chloro-1-(4-nitrophenyl)isochromane chemical structure, C15H12ClNO3, CAS 220444-99-5
7-Chloro-1-(4-nitrophenyl)isochromane
CAS 220444-99-5C15H12ClNO3