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Murcko scaffold

Ring system with 3 rings and 18 atoms

18 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
18
With full pages
4
Scaffold SMILES

c1ccc(-c2ccnc(-c3cccnc3)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(-c2ccnc(-c3cccnc3)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 18 of 18 chemicals

N-Methyl-4-phenyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide chemical structure, C17H14N4O, CAS 400079-48-3
N-Methyl-4-phenyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide
CAS 400079-48-3C17H14N4O
N-Ethyl-4-phenyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide chemical structure, C18H16N4O, CAS 400079-49-4
N-Ethyl-4-phenyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide
CAS 400079-49-4C18H16N4O
N-(1,1-Dimethyl-2-propynyl)-4-phenyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide chemical structure, C21H18N4O, CAS 400079-55-2
N-(1,1-Dimethyl-2-propynyl)-4-phenyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide
CAS 400079-55-2C21H18N4O
4-(2-Chlorophenyl)-5-(methylsulfonyl)-2-(3-pyridinyl)pyrimidine chemical structure, C16H12ClN3O2S, CAS 251307-34-3
4-(2-Chlorophenyl)-5-(methylsulfonyl)-2-(3-pyridinyl)pyrimidine
CAS 251307-34-3C16H12ClN3O2S
4-Chloro-6-phenyl-2-(3-pyridinyl)-5-pyrimidinecarbonitrile chemical structure, C16H9ClN4, CAS 320417-51-4
4-Chloro-6-phenyl-2-(3-pyridinyl)-5-pyrimidinecarbonitrile
CAS 320417-51-4C16H9ClN4
4-(4-Chlorophenyl)-6-(dimethylamino)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile chemical structure, C18H14ClN5, CAS 320417-53-6
4-(4-Chlorophenyl)-6-(dimethylamino)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile
CAS 320417-53-6C18H14ClN5
4-(4-Chlorophenyl)-6-(methylamino)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile chemical structure, C17H12ClN5, CAS 320417-54-7
4-(4-Chlorophenyl)-6-(methylamino)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile
CAS 320417-54-7C17H12ClN5
4-Chloro-6-(4-chlorophenyl)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile chemical structure, C16H8Cl2N4, CAS 320417-58-1
4-Chloro-6-(4-chlorophenyl)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile
CAS 320417-58-1C16H8Cl2N4
4-(Dimethylamino)-6-phenyl-2-(3-pyridinyl)-5-pyrimidinecarbonitrile chemical structure, C18H15N5, CAS 320417-70-7
4-(Dimethylamino)-6-phenyl-2-(3-pyridinyl)-5-pyrimidinecarbonitrile
CAS 320417-70-7C18H15N5
4-(Isopropylamino)-6-phenyl-2-(3-pyridinyl)-5-pyrimidinecarbonitrile chemical structure, C19H17N5, CAS 320417-80-9
4-(Isopropylamino)-6-phenyl-2-(3-pyridinyl)-5-pyrimidinecarbonitrile
CAS 320417-80-9C19H17N5
4-(4-Chlorophenyl)-6-(isopropylamino)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile chemical structure, C19H16ClN5, CAS 320417-88-7
4-(4-Chlorophenyl)-6-(isopropylamino)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile
CAS 320417-88-7C19H16ClN5
5-Methylsulfinyl-4-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)pyridin-3-yl]pyrimidine chemical structure, C18H11F6N3OS, CAS 958559-82-5
5-Methylsulfinyl-4-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)pyridin-3-yl]pyrimidine
CAS 958559-82-5C18H11F6N3OS
4-Phenyl-N-propyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide chemical structure, C19H18N4O, CAS 400079-50-7
4-Phenyl-N-propyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide
CAS 400079-50-7C19H18N4O
N-Butyl-4-phenyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide chemical structure, C20H20N4O, CAS 400079-52-9
N-Butyl-4-phenyl-2-(3-pyridinyl)-5-pyrimidinecarboxamide
CAS 400079-52-9C20H20N4O
(5-(4-(3-(tert-Butyl)-4-isopropoxyphenyl)pyrimidin-2-yl)pyridin-2-yl)methanamine chemical structure, C23H28N4O, CAS 1378366-66-5
(5-(4-(3-(tert-Butyl)-4-isopropoxyphenyl)pyrimidin-2-yl)pyridin-2-yl)methanamine
CAS 1378366-66-5C23H28N4O
5-(4-(3-(tert-Butyl)-4-isopropoxyphenyl)pyrimidin-2-yl)picolinonitrile chemical structure, C23H24N4O, CAS 1378368-18-3
5-(4-(3-(tert-Butyl)-4-isopropoxyphenyl)pyrimidin-2-yl)picolinonitrile
CAS 1378368-18-3C23H24N4O
4-Chloro-6-(4-chlorophenyl)-2-(pyridin-3-yl)pyrimidine chemical structure, C15H9Cl2N3, CAS 1354770-94-7
4-Chloro-6-(4-chlorophenyl)-2-(pyridin-3-yl)pyrimidine
CAS 1354770-94-7C15H9Cl2N3
AHR antagonist 2 chemical structure, C20H17F3N4O3, CAS 2338747-54-7
AHR antagonist 2
CAS 2338747-54-7C20H17F3N4O3