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Murcko scaffold

Ring system with 3 rings and 18 atoms

14 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 18
Chemicals: 14
With full pages: 4

Scaffold SMILES

c1ccc(Nc2nccc(N3CCCC3)n2)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(Nc2nccc(N3CCCC3)n2)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 14 of 14 chemicals

2-N-Methyl-5-nitro-2-N-phenyl-6-pyrrolidin-1-ylpyrimidine-2,4-diamine chemical structure, C15H18N6O2, CAS 673494-38-7

2-N-Methyl-5-nitro-2-N-phenyl-6-pyrrolidin-1-ylpyrimidine-2,4-diamine

CAS 673494-38-7C₁₅H₁₈N₆O₂

2-N-(2-Fluorophenyl)-5-nitro-6-pyrrolidin-1-ylpyrimidine-2,4-diamine chemical structure, C14H15FN6O2, CAS 674296-05-0

2-N-(2-Fluorophenyl)-5-nitro-6-pyrrolidin-1-ylpyrimidine-2,4-diamine

CAS 674296-05-0C₁₄H₁₅FN₆O₂

2-N-(4-Methoxyphenyl)-5-nitro-6-pyrrolidin-1-ylpyrimidine-2,4-diamine chemical structure, C15H18N6O3, CAS 674294-50-9

2-N-(4-Methoxyphenyl)-5-nitro-6-pyrrolidin-1-ylpyrimidine-2,4-diamine

CAS 674294-50-9C₁₅H₁₈N₆O₃

5-Nitro-2-N-phenyl-6-pyrrolidin-1-ylpyrimidine-2,4-diamine chemical structure, C14H16N6O2, CAS 673441-40-2

5-Nitro-2-N-phenyl-6-pyrrolidin-1-ylpyrimidine-2,4-diamine

CAS 673441-40-2C₁₄H₁₆N₆O₂

3-Methyl-N-(4-{[4-methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]amino}phenyl)butanamide chemical structure, C20H27N5O, CAS 946268-08-2

3-Methyl-N-(4-{[4-methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]amino}phenyl)butanamide

CAS 946268-08-2C₂₀H₂₇N₅O

N-(4-{[4-Methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]amino}phenyl)butanamide chemical structure, C19H25N5O, CAS 946245-06-3

N-(4-{[4-Methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]amino}phenyl)butanamide

CAS 946245-06-3C₁₉H₂₅N₅O

N-(4-((4-Methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl)amino)phenyl)pentanamide chemical structure, C20H27N5O, CAS 946295-02-9

N-(4-((4-Methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl)amino)phenyl)pentanamide

CAS 946295-02-9C₂₀H₂₇N₅O

N-(3-Fluorophenyl)-4-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidin-2-amine chemical structure, C15H16FN5O2, CAS 1203279-34-8

N-(3-Fluorophenyl)-4-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidin-2-amine

CAS 1203279-34-8C₁₅H₁₆FN₅O₂

N-(2,4-Dimethoxyphenyl)-4-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidin-2-amine chemical structure, C17H21N5O4, CAS 1208782-41-5

N-(2,4-Dimethoxyphenyl)-4-methyl-5-nitro-6-(pyrrolidin-1-yl)pyrimidin-2-amine

CAS 1208782-41-5C₁₇H₂₁N₅O₄

(S)-N-(1-(2-((4-Amino-3-nitrophenyl)amino)-6-propylpyrimidin-4-yl)pyrrolidin-3-yl)acetamide chemical structure, C19H25N7O3, CAS 1394316-91-6

(S)-N-(1-(2-((4-Amino-3-nitrophenyl)amino)-6-propylpyrimidin-4-yl)pyrrolidin-3-yl)acetamide

CAS 1394316-91-6C₁₉H₂₅N₇O₃

Pxa5rxj8P5 chemical structure, C19H26ClN7O3, CAS 1394317-23-7

CAS 1394317-23-7C₁₉H₂₆ClN₇O₃

3-((4-(Pyrrolidin-1-yl)pyrimidin-2-yl)amino)benzoic acid chemical structure, C15H16N4O2, CAS 1239757-39-1

3-((4-(Pyrrolidin-1-yl)pyrimidin-2-yl)amino)benzoic acid

CAS 1239757-39-1C₁₅H₁₆N₄O₂

N1-[4-Methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]benzene-1,4-diamine chemical structure, C15H19N5, CAS 1706457-04-6

N1-[4-Methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]benzene-1,4-diamine

CAS 1706457-04-6C₁₅H₁₉N₅

Ethyl 3-[(4-pyrrolidin-1-ylpyrimidin-2-yl)amino]benzoate chemical structure, C17H20N4O2, CAS 3085427-76-2

Ethyl 3-[(4-pyrrolidin-1-ylpyrimidin-2-yl)amino]benzoate

CAS 3085427-76-2C₁₇H₂₀N₄O₂