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Murcko scaffold

1-Phenylisoquinoline scaffold

156 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
16
Chemicals
156
With full pages
14
Scaffold SMILES

c1ccc(-c2nccc3ccccc23)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 1-Phenylisoquinoline page
Murcko scaffold c1ccc(-c2nccc3ccccc23)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 145 to 156 of 156 chemicals

1-(3,5-Dimethylphenyl)-6-propylIsoquinoline chemical structure, C20H21N, CAS 2231731-59-0
1-(3,5-Dimethylphenyl)-6-propylIsoquinoline
CAS 2231731-59-0C20H21N
Phenol, 2-(1-isoquinolinyl)- chemical structure, C15H11NO, CAS 56268-57-6
Phenol, 2-(1-isoquinolinyl)-
CAS 56268-57-6C15H11NO
Isoquinoline, 6-chloro-1-(3,5-dimethylphenyl)- chemical structure, C17H14ClN, CAS 2324822-82-2
Isoquinoline, 6-chloro-1-(3,5-dimethylphenyl)-
CAS 2324822-82-2C17H14ClN
Orb1687076 chemical structure, C19H18NNa2O8P, CAS 2376321-67-2
Orb1687076
CAS 2376321-67-2C19H18NNa2O8P
Hsd17B13-IN-39 chemical structure, C15H11NO2, CAS 2730022-55-4
Hsd17B13-IN-39
CAS 2730022-55-4C15H11NO2
Isoquinoline, 6-methoxy-1-(4-methoxyphenyl)- chemical structure, C17H15NO2, CAS 52986-72-8
Isoquinoline, 6-methoxy-1-(4-methoxyphenyl)-
CAS 52986-72-8C17H15NO2
3-Methyl-1-(4-nitrophenyl)isoquinoline chemical structure, C16H12N2O2, CAS 94205-63-7
3-Methyl-1-(4-nitrophenyl)isoquinoline
CAS 94205-63-7C16H12N2O2
2-(1-Methylacetonyl)-1-phenylisoquinolinium bromide chemical structure, C19H18BrNO, CAS 2009-07-6
2-(1-Methylacetonyl)-1-phenylisoquinolinium bromide
CAS 2009-07-6C19H18BrNO
1-(3,5-Dimethylphenyl)-7-(2,2,2-trifluoroethyl)isoquinoline chemical structure, C19H16F3N, CAS 1902141-87-0
1-(3,5-Dimethylphenyl)-7-(2,2,2-trifluoroethyl)isoquinoline
CAS 1902141-87-0C19H16F3N
Bis[(4-n-hexylphenyl)isoquinoline](acetylacetonate)iridium (III) chemical structure, C47H51IrN2O2, CAS 435294-13-6
Bis[(4-n-hexylphenyl)isoquinoline](acetylacetonate)iridium (III)
CAS 435294-13-6C47H51IrN2O2
Bis[2-(1-isoquinolinyl)phenyl](2,2,6,6-tetramethyl-3,5-heptanedionato)iridium chemical structure, C41H39IrN2O2, CAS 1202867-58-0
Bis[2-(1-isoquinolinyl)phenyl](2,2,6,6-tetramethyl-3,5-heptanedionato)iridium
CAS 1202867-58-0C41H39IrN2O2
Methyl 2-(6,7-Dimethoxyisoquinolin-1-yl)-5-methoxybenzoate chemical structure, C20H19NO5, CAS 88741-65-5
Methyl 2-(6,7-Dimethoxyisoquinolin-1-yl)-5-methoxybenzoate
CAS 88741-65-5C20H19NO5