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Murcko scaffold

Ring system with 3 rings and 21 atoms

16 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
16
With full pages
0
Scaffold SMILES

O=c1[nH]c(=O)n(C2CCCO2)cc1C#Cc1ccccc1

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 O=c1[nH]c(=O)n(C2CCCO2)cc1C#Cc1ccccc1

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 16 of 16 chemicals

2'-Deoxy-5-[(4-propylphenyl)ethynyl]uridine chemical structure, C20H22N2O5, CAS 319425-60-0
2'-Deoxy-5-[(4-propylphenyl)ethynyl]uridine
CAS 319425-60-0C20H22N2O5
5-Phenylethynyluridine chemical structure, C17H16N2O6, CAS 649558-84-9
5-Phenylethynyluridine
CAS 649558-84-9C17H16N2O6
1-[(2R,3R,4R,5R)-4-Hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-5-[2-[4-(trifluoromethyl)phenyl]ethynyl]pyrimidine-2,4-dione chemical structure, C19H17F3N2O6, CAS 547751-25-7
1-[(2R,3R,4R,5R)-4-Hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-5-[2-[4-(trifluoromethyl)phenyl]ethynyl]pyrimidine-2,4-dione
CAS 547751-25-7C19H17F3N2O6
1-[(2R,3R,4R,5R)-4-Hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-5-[2-(4-methoxyphenyl)ethynyl]pyrimidine-2,4-dione chemical structure, C19H20N2O7, CAS 547751-23-5
1-[(2R,3R,4R,5R)-4-Hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]-5-[2-(4-methoxyphenyl)ethynyl]pyrimidine-2,4-dione
CAS 547751-23-5C19H20N2O7
AG-H-12223 chemical structure, C17H16N2O5, CAS 77887-20-8
AG-H-12223
CAS 77887-20-8C17H16N2O5
5-[2-(4-tert-Butylphenyl)ethynyl]-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione chemical structure, C21H24N2O5, CAS 596107-17-4
5-[2-(4-tert-Butylphenyl)ethynyl]-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
CAS 596107-17-4C21H24N2O5
2'-Deoxy-5-[(4-methylphenyl)ethynyl]uridine chemical structure, C18H18N2O5, CAS 376367-55-4
2'-Deoxy-5-[(4-methylphenyl)ethynyl]uridine
CAS 376367-55-4C18H18N2O5
Uridine, 2 inverted exclamation marka-deoxy-5-(2-phenylethynyl)-, 3 inverted exclamation marka,5 inverted exclamation marka-diacetate chemical structure, C21H20N2O7, CAS 943446-57-9
Uridine, 2 inverted exclamation marka-deoxy-5-(2-phenylethynyl)-, 3 inverted exclamation marka,5 inverted exclamation marka-diacetate
CAS 943446-57-9C21H20N2O7
2'-Deoxy-5-[(4-methoxyphenyl)ethynyl]uridine chemical structure, C18H18N2O6, CAS 151362-04-8
2'-Deoxy-5-[(4-methoxyphenyl)ethynyl]uridine
CAS 151362-04-8C18H18N2O6
2'-Deoxy-5-[(4-pentylphenyl)ethynyl]uridine chemical structure, C22H26N2O5, CAS 376367-59-8
2'-Deoxy-5-[(4-pentylphenyl)ethynyl]uridine
CAS 376367-59-8C22H26N2O5
2'-Deoxy-5-[(3,5-difluorophenyl)ethynyl]uridine chemical structure, C17H14F2N2O5, CAS 151362-07-1
2'-Deoxy-5-[(3,5-difluorophenyl)ethynyl]uridine
CAS 151362-07-1C17H14F2N2O5
2'-Deoxy-5-[[4-[(trifluoromethyl)phenyl]ethynyl]uridine chemical structure, C18H15F3N2O5, CAS 151362-08-2
2'-Deoxy-5-[[4-[(trifluoromethyl)phenyl]ethynyl]uridine
CAS 151362-08-2C18H15F3N2O5
2'-Deoxy-5-[(4-fluorophenyl)ethynyl]uridine chemical structure, C17H15FN2O5, CAS 151362-02-6
2'-Deoxy-5-[(4-fluorophenyl)ethynyl]uridine
CAS 151362-02-6C17H15FN2O5
2'-Deoxy-5-[(4-ethylphenyl)ethynyl]uridine chemical structure, C19H20N2O5, CAS 376367-56-5
2'-Deoxy-5-[(4-ethylphenyl)ethynyl]uridine
CAS 376367-56-5C19H20N2O5
5-[(4-Butylphenyl)ethynyl]-2'-deoxyuridine chemical structure, C21H24N2O5, CAS 376367-57-6
5-[(4-Butylphenyl)ethynyl]-2'-deoxyuridine
CAS 376367-57-6C21H24N2O5
2'-O-Methyl-5-(phenylethynyl)uridine chemical structure, C18H18N2O6, CAS 547751-21-3
2'-O-Methyl-5-(phenylethynyl)uridine
CAS 547751-21-3C18H18N2O6