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Murcko scaffold

Ring system with 3 rings and 14 atoms

18 chemicals on CompoundList share this ring system.

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

c1ccc(-n2c[n+]3c(n2)CCC3)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(-n2c[n+]3c(n2)CCC3)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

6,7-Dihydro-2-pentafluorophenyl-5H-pyrrolo[2,1-c]-1,2,4-triazolium tetrafluoroborate chemical structure, C11H7BF9N3, CAS 862095-91-8
6,7-Dihydro-2-pentafluorophenyl-5H-pyrrolo[2,1-c]-1,2,4-triazolium tetrafluoroborate
CAS 862095-91-8C11H7BF9N3
2-Phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium chloride chemical structure, C11H12ClN3, CAS 828914-68-7
2-Phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium chloride
CAS 828914-68-7C11H12ClN3
2-Mesityl-6,7-dihydro-5H-pyrrolo(2,1-c)(1,2,4)triazol-2-ium tetrafluoroborate chemical structure, C14H18BF4N3, CAS 862893-80-9
2-Mesityl-6,7-dihydro-5H-pyrrolo(2,1-c)(1,2,4)triazol-2-ium tetrafluoroborate
CAS 862893-80-9C14H18BF4N3
Bode catalyst 3 chemical structure, C14H18ClN3, CAS 862893-81-0
Bode catalyst 3
CAS 862893-81-0C14H18ClN3
2-Phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate chemical structure, C11H12BF4N3, CAS 909122-64-1
2-Phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
CAS 909122-64-1C11H12BF4N3
(5R,7R)-7-Fluoro-5-isopropyl-2-(perfluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-C][1,2,4]triazol-2-ium tetrafluoroborate chemical structure, C14H12BF10N3, CAS 1311991-39-5
(5R,7R)-7-Fluoro-5-isopropyl-2-(perfluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-C][1,2,4]triazol-2-ium tetrafluoroborate
CAS 1311991-39-5C14H12BF10N3
6,7-Dihydro-2-(2,4,6-trimethylphenyl)-5H-pyrrolo(2,1-c)-1,2,4-triazolium Perchlorate chemical structure, C14H18ClN3O4, CAS 1334529-08-6
6,7-Dihydro-2-(2,4,6-trimethylphenyl)-5H-pyrrolo(2,1-c)-1,2,4-triazolium Perchlorate
CAS 1334529-08-6C14H18ClN3O4
(R)-5-Isopropyl-2-phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate chemical structure, C14H18BF4N3, CAS 1448816-59-8
(R)-5-Isopropyl-2-phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
CAS 1448816-59-8C14H18BF4N3
(R)-5-(tert-Butyl)-2-phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate chemical structure, C15H20BF4N3, CAS 1448816-61-2
(R)-5-(tert-Butyl)-2-phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
CAS 1448816-61-2C15H20BF4N3
2-(2,4,6-Trichlorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate chemical structure, C11H9BCl3F4N3, CAS 1353251-02-1
2-(2,4,6-Trichlorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
CAS 1353251-02-1C11H9BCl3F4N3
(S)-5-(Aminomethyl)-2-mesityl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium chloride chemical structure, C15H21ClN4, CAS 1269473-12-2
(S)-5-(Aminomethyl)-2-mesityl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium chloride
CAS 1269473-12-2C15H21ClN4
(R)-5-Isopropyl-2-(perfluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate chemical structure, C14H13BF9N3, CAS 1175052-07-9
(R)-5-Isopropyl-2-(perfluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
CAS 1175052-07-9C14H13BF9N3
2-(4-(Trifluoromethyl)phenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate chemical structure, C12H11BF7N3, CAS 2173054-52-7
2-(4-(Trifluoromethyl)phenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
CAS 2173054-52-7C12H11BF7N3
(R)-5-(tert-Butyl)-2-phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate chemical structure, C15H20BF4N3
(R)-5-(tert-Butyl)-2-phenyl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
C15H20BF4N3
(5R)-5-tert-Butyl-2-(2,3,4,5,6-pentafluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-4-ium tetrafluoroborate chemical structure, C15H15BF9N3, CAS 1355451-64-7
(5R)-5-tert-Butyl-2-(2,3,4,5,6-pentafluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-4-ium tetrafluoroborate
CAS 1355451-64-7C15H15BF9N3
(5R,7R)-5-tert-Butyl-7-fluoro-2-(2,3,4,5,6-pentafluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-4-ium tetrafluoroborate chemical structure, C15H14BF10N3, CAS 1355451-60-3
(5R,7R)-5-tert-Butyl-7-fluoro-2-(2,3,4,5,6-pentafluorophenyl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-4-ium tetrafluoroborate
CAS 1355451-60-3C15H14BF10N3
(S)-5-(((tert-Butyldimethylsilyl)oxy)methyl)-2-mesityl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium chloride chemical structure, C21H34ClN3OSi, CAS 1356583-08-8
(S)-5-(((tert-Butyldimethylsilyl)oxy)methyl)-2-mesityl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium chloride
CAS 1356583-08-8C21H34ClN3OSi
(R)-5-Isopropyl-2-mesityl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate chemical structure, C17H24BF4N3, CAS 2216797-99-6
(R)-5-Isopropyl-2-mesityl-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-2-ium tetrafluoroborate
CAS 2216797-99-6C17H24BF4N3