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Murcko scaffold

Ring system with 3 rings and 28 atoms

12 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
28
Chemicals
12
With full pages
5
Scaffold SMILES

O=C(COC(=O)c1cccnc1)Nc1cn(Cc2ccccc2)c(=O)[nH]c1=O

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=C(COC(=O)c1cccnc1)Nc1cn(Cc2ccccc2)c(=O)[nH]c1=O

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 12 of 12 chemicals

[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(propyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate chemical structure, C22H21Cl2N5O5, CAS 924412-21-5
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(propyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate
CAS 924412-21-5C22H21Cl2N5O5
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methylpropyl)carbamoyl]methyl 6-chloropyridine-3-carboxylate chemical structure, C23H24ClN5O5, CAS 1016482-24-8
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methylpropyl)carbamoyl]methyl 6-chloropyridine-3-carboxylate
CAS 1016482-24-8C23H24ClN5O5
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methylpropyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate chemical structure, C23H23Cl2N5O5, CAS 1016484-27-7
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methylpropyl)carbamoyl]methyl 5,6-dichloropyridine-3-carboxylate
CAS 1016484-27-7C23H23Cl2N5O5
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methoxyethyl)carbamoyl]methyl 6-chloropyridine-3-carboxylate chemical structure, C22H22ClN5O6, CAS 1016486-06-8
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methoxyethyl)carbamoyl]methyl 6-chloropyridine-3-carboxylate
CAS 1016486-06-8C22H22ClN5O6
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methoxyethyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate chemical structure, C23H25N5O6S, CAS 1016474-17-1
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methoxyethyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate
CAS 1016474-17-1C23H25N5O6S
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methylpropyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate chemical structure, C24H27N5O5S, CAS 1090936-01-8
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methylpropyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate
CAS 1090936-01-8C24H27N5O5S
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(methyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate chemical structure, C21H21N5O5S, CAS 1031078-32-6
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(methyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate
CAS 1031078-32-6C21H21N5O5S
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methoxyethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate chemical structure, C22H22ClN5O6, CAS 1031034-90-8
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methoxyethyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate
CAS 1031034-90-8C22H22ClN5O6
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methylpropyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate chemical structure, C23H24ClN5O5, CAS 1031487-04-3
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(2-methylpropyl)carbamoyl]methyl 2-chloropyridine-3-carboxylate
CAS 1031487-04-3C23H24ClN5O5
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(methyl)carbamoyl]methyl 6-chloropyridine-3-carboxylate chemical structure, C20H18ClN5O5, CAS 1031049-39-4
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(methyl)carbamoyl]methyl 6-chloropyridine-3-carboxylate
CAS 1031049-39-4C20H18ClN5O5
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(ethyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate chemical structure, C22H23N5O5S, CAS 1090471-24-1
[(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)(ethyl)carbamoyl]methyl 2-(methylsulfanyl)pyridine-3-carboxylate
CAS 1090471-24-1C22H23N5O5S
[2-[(6-Amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-ethylamino]-2-oxoethyl] 2-chloropyridine-3-carboxylate chemical structure, C21H20ClN5O5, CAS 1090898-07-9
[2-[(6-Amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-ethylamino]-2-oxoethyl] 2-chloropyridine-3-carboxylate
CAS 1090898-07-9C21H20ClN5O5