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Murcko scaffold

Phenyl isonicotinate scaffold

25 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
15
Chemicals
25
With full pages
4
Scaffold SMILES

O=C(Oc1ccccc1)c1ccncc1

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 Phenyl isonicotinate page
Murcko scaffold O=C(Oc1ccccc1)c1ccncc1

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 25 of 25 chemicals

Phenyl isonicotinate chemical structure, C12H9NO2, CAS 94-00-8
Phenyl isonicotinate
CAS 94-00-8C12H9NO2
2-(Methoxycarbonyl)phenyl isonicotinate chemical structure, C14H11NO4, CAS 296276-38-5
2-(Methoxycarbonyl)phenyl isonicotinate
CAS 296276-38-5C14H11NO4
5-Ethyl-2-methylphenyl isonicotinate chemical structure, C15H15NO2, CAS 723759-39-5
5-Ethyl-2-methylphenyl isonicotinate
CAS 723759-39-5C15H15NO2
4-Formyl-2-methoxyphenyl 4-pyridinecarboxylate chemical structure, C14H11NO4, CAS 379727-11-4
4-Formyl-2-methoxyphenyl 4-pyridinecarboxylate
CAS 379727-11-4C14H11NO4
4-Pyridinecarboxylic acid, 2-(methoxycarbonyl)phenyl ester, 1-oxide chemical structure, C14H11NO5, CAS 65101-49-7
4-Pyridinecarboxylic acid, 2-(methoxycarbonyl)phenyl ester, 1-oxide
CAS 65101-49-7C14H11NO5
(4-Bromo-2-chloro-6-methylphenyl) pyridine-4-carboxylate chemical structure, C13H9BrClNO2, CAS 848066-13-7
(4-Bromo-2-chloro-6-methylphenyl) pyridine-4-carboxylate
CAS 848066-13-7C13H9BrClNO2
4-Pyridinecarboxylic acid, 4-nitrophenyl ester chemical structure, C12H8N2O4, CAS 2882-35-1
4-Pyridinecarboxylic acid, 4-nitrophenyl ester
CAS 2882-35-1C12H8N2O4
Pentafluorophenyl pyridine-4-carboxylate chemical structure, C12H4F5NO2, CAS 360574-34-1
Pentafluorophenyl pyridine-4-carboxylate
CAS 360574-34-1C12H4F5NO2
2-Acetylphenyl 2,6-dichloroisonicotinate chemical structure, C14H9Cl2NO3, CAS 647824-79-1
2-Acetylphenyl 2,6-dichloroisonicotinate
CAS 647824-79-1C14H9Cl2NO3
2-Chloro-4-fluorophenyl 2,6-dichloroisonicotinate chemical structure, C12H5Cl3FNO2, CAS 218928-46-2
2-Chloro-4-fluorophenyl 2,6-dichloroisonicotinate
CAS 218928-46-2C12H5Cl3FNO2
4-(Cyanomethyl)phenyl 2,6-dichloroisonicotinate chemical structure, C14H8Cl2N2O2, CAS 287978-83-0
4-(Cyanomethyl)phenyl 2,6-dichloroisonicotinate
CAS 287978-83-0C14H8Cl2N2O2
4-Chlorophenyl 2-chloroisonicotinate chemical structure, C12H7Cl2NO2, CAS 680217-62-3
4-Chlorophenyl 2-chloroisonicotinate
CAS 680217-62-3C12H7Cl2NO2
4-Pentylphenyl 4-pyridinecarboxylate chemical structure, C17H19NO2, CAS 313372-75-7
4-Pentylphenyl 4-pyridinecarboxylate
CAS 313372-75-7C17H19NO2
Pyridinium, 1-methyl-4-[(4-nitrophenoxy)carbonyl]- chemical structure, C13H11N2O4+, CAS 185542-57-8
Pyridinium, 1-methyl-4-[(4-nitrophenoxy)carbonyl]-
CAS 185542-57-8C13H11N2O4+
4-{[2-(Methoxycarbonyl)phenoxy]carbonyl}-1-methylpyridin-1-ium iodide chemical structure, C15H14INO4, CAS 319911-11-0
4-{[2-(Methoxycarbonyl)phenoxy]carbonyl}-1-methylpyridin-1-ium iodide
CAS 319911-11-0C15H14INO4
4-Acetylphenyl 2,6-dichloropyridine-4-carboxylate chemical structure, C14H9Cl2NO3, CAS 1031121-31-9
4-Acetylphenyl 2,6-dichloropyridine-4-carboxylate
CAS 1031121-31-9C14H9Cl2NO3
2-Acetylphenyl isonicotinate chemical structure, C14H11NO3, CAS 93717-62-5
2-Acetylphenyl isonicotinate
CAS 93717-62-5C14H11NO3
[3-(Methoxymethyl)phenyl] 2-fluoropyridine-4-carboxylate chemical structure, C14H12FNO3, CAS 1436348-67-2
[3-(Methoxymethyl)phenyl] 2-fluoropyridine-4-carboxylate
CAS 1436348-67-2C14H12FNO3
4-((Nitrooxy)methyl)phenyl isonicotinate chemical structure, C13H10N2O5, CAS 2444010-38-0
4-((Nitrooxy)methyl)phenyl isonicotinate
CAS 2444010-38-0C13H10N2O5
3-((Nitrooxy)methyl)phenyl isonicotinate chemical structure, C13H10N2O5, CAS 2444010-45-9
3-((Nitrooxy)methyl)phenyl isonicotinate
CAS 2444010-45-9C13H10N2O5
[2,4-Di(propan-2-yloxy)phenyl] 2-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-4-carboxylate chemical structure, C27H40N4O5, CAS 2410512-38-6
[2,4-Di(propan-2-yloxy)phenyl] 2-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]pyridine-4-carboxylate
CAS 2410512-38-6C27H40N4O5
JQKD82 trihydrochloride chemical structure, C27H43Cl3N4O5, CAS 2863676-87-1
JQKD82 trihydrochloride
CAS 2863676-87-1C27H43Cl3N4O5
Phenyl 3-iodo-4-pyridinecarboxylate chemical structure, C12H8INO2, CAS 4502-18-5
Phenyl 3-iodo-4-pyridinecarboxylate
CAS 4502-18-5C12H8INO2
JQKD82 (dihydrochloride) chemical structure, C27H42Cl2N4O5, CAS 2863635-05-4
JQKD82 (dihydrochloride)
CAS 2863635-05-4C27H42Cl2N4O5