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Murcko scaffold

Ring system with 2 rings and 13 atoms

66 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
13
Chemicals
66
With full pages
4
Scaffold SMILES

c1ccc(NC2CCCCO2)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(NC2CCCCO2)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 66 chemicals

Acetophenone, 4'-(beta-D-glucopyranosylamino)- chemical structure, C14H19NO6, CAS 10563-84-5
Acetophenone, 4'-(beta-D-glucopyranosylamino)-
CAS 10563-84-5C14H19NO6
Acetophenone, 4'-(arabinosylamino)- chemical structure, C13H17NO5, CAS 28905-03-5
Acetophenone, 4'-(arabinosylamino)-
CAS 28905-03-5C13H17NO5
Benaxibine chemical structure, C12H15NO6, CAS 27661-27-4
Benaxibine
CAS 27661-27-4C12H15NO6
N-p-Nitrophenyl-D-ribosylamine triacetate chemical structure, C17H20N2O9, CAS 109527-10-8
N-p-Nitrophenyl-D-ribosylamine triacetate
CAS 109527-10-8C17H20N2O9
D-Xylopyranosylamine, N-(4-nitrophenyl)-, 2,3,4-triacetate chemical structure, C17H20N2O9, CAS 109785-47-9
D-Xylopyranosylamine, N-(4-nitrophenyl)-, 2,3,4-triacetate
CAS 109785-47-9C17H20N2O9
N-Glucopyranosyl-5-aminosalicylic acid chemical structure, C13H17NO8, CAS 123135-21-7
N-Glucopyranosyl-5-aminosalicylic acid
CAS 123135-21-7C13H17NO8
N-Nitroso-N-p-nitrophenyl-D-ribosylamine chemical structure, C11H13N3O7, CAS 111955-14-7
N-Nitroso-N-p-nitrophenyl-D-ribosylamine
CAS 111955-14-7C11H13N3O7
N-Nitroso-N-p-nitrophenyl-L-arabinosylamine chemical structure, C11H13N3O7, CAS 111955-15-8
N-Nitroso-N-p-nitrophenyl-L-arabinosylamine
CAS 111955-15-8C11H13N3O7
N-p-Methylphenyl-D-arabinosylamine chemical structure, C12H17NO4, CAS 111955-16-9
N-p-Methylphenyl-D-arabinosylamine
CAS 111955-16-9C12H17NO4
N-Nitroso-N-p-nitrophenyl-D-xylosylamine chemical structure, C11H13N3O7, CAS 111955-18-1
N-Nitroso-N-p-nitrophenyl-D-xylosylamine
CAS 111955-18-1C11H13N3O7
N-Nitroso-N-p-nitrophenyl-D-lyxosylamine chemical structure, C11H13N3O7, CAS 111955-21-6
N-Nitroso-N-p-nitrophenyl-D-lyxosylamine
CAS 111955-21-6C11H13N3O7
4-Aminobenzoic acid-N-mannoside chemical structure, C13H17NO7, CAS 72150-99-3
4-Aminobenzoic acid-N-mannoside
CAS 72150-99-3C13H17NO7
N-(4-Tolyl)-D-glucosylamine chemical structure, C13H19NO5, CAS 29355-12-2
N-(4-Tolyl)-D-glucosylamine
CAS 29355-12-2C13H19NO5
N-p-Methylphenyl-D-xylosylamine chemical structure, C12H17NO4, CAS 3054-60-2
N-p-Methylphenyl-D-xylosylamine
CAS 3054-60-2C12H17NO4
N-Nitroso-N-p-carboxyphenyl-D-arabinosylamine chemical structure, C12H14N2O7, CAS 111858-64-1
N-Nitroso-N-p-carboxyphenyl-D-arabinosylamine
CAS 111858-64-1C12H14N2O7
N-(4-Ethoxyphenyl)hexopyranosylamine chemical structure, C14H21NO6, CAS 5346-29-2
N-(4-Ethoxyphenyl)hexopyranosylamine
CAS 5346-29-2C14H21NO6
N-p-Carboxyphenyl-D-xylosylamine chemical structure, C12H15NO6, CAS 10396-71-1
N-p-Carboxyphenyl-D-xylosylamine
CAS 10396-71-1C12H15NO6
2-(Acetylamino)-2-deoxy-N-(4-ethoxyphenyl)hexopyranosylamine chemical structure, C16H24N2O6, CAS 7150-38-1
2-(Acetylamino)-2-deoxy-N-(4-ethoxyphenyl)hexopyranosylamine
CAS 7150-38-1C16H24N2O6
[3,4,5-Triacetyloxy-6-(4-nitroanilino)oxan-2-yl]methyl acetate chemical structure, C20H24N2O11, CAS 26302-39-6
[3,4,5-Triacetyloxy-6-(4-nitroanilino)oxan-2-yl]methyl acetate
CAS 26302-39-6C20H24N2O11
N-(4-Methylphenyl)hexopyranosylamine chemical structure, C13H19NO5, CAS 10571-77-4
N-(4-Methylphenyl)hexopyranosylamine
CAS 10571-77-4C13H19NO5
2,3,4,6-Tetra-O-methyl-N-phenylhexopyranosylamine chemical structure, C16H25NO5, CAS 54083-21-5
2,3,4,6-Tetra-O-methyl-N-phenylhexopyranosylamine
CAS 54083-21-5C16H25NO5
2-Anilino-6-(hydroxymethyl)oxane-3,4,5-triol chemical structure, C12H17NO5, CAS 5154-10-9
2-Anilino-6-(hydroxymethyl)oxane-3,4,5-triol
CAS 5154-10-9C12H17NO5
N-(4-Nitrophenyl)hexopyranosylamine chemical structure, C12H16N2O7, CAS 2893-21-2
N-(4-Nitrophenyl)hexopyranosylamine
CAS 2893-21-2C12H16N2O7
2-(4-Chloroanilino)-6-(hydroxymethyl)oxane-3,4,5-triol chemical structure, C12H16ClNO5, CAS 5975-03-1
2-(4-Chloroanilino)-6-(hydroxymethyl)oxane-3,4,5-triol
CAS 5975-03-1C12H16ClNO5