CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 19 atoms

19 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
19
Chemicals
19
With full pages
4
Scaffold SMILES

c1ccc(C(Cn2cncn2)Cn2cncn2)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(C(Cn2cncn2)Cn2cncn2)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 19 of 19 chemicals

Fluconazole chemical structure, C13H12F2N6O, CAS 86386-73-4
Fluconazole
CAS 86386-73-4C13H12F2N6O
alpha-(2,4-Dichlorophenyl)-alpha-(1H-1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole-1-ethanol chemical structure, C13H12Cl2N6O, CAS 81886-52-4
alpha-(2,4-Dichlorophenyl)-alpha-(1H-1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole-1-ethanol
CAS 81886-52-4C13H12Cl2N6O
1H-1,2,4-Triazole-1-ethanol, alpha-(4-chlorophenyl)-alpha-(1H-1,2,4-triazol-1-ylmethyl)- chemical structure, C13H13ClN6O, CAS 81886-49-9
1H-1,2,4-Triazole-1-ethanol, alpha-(4-chlorophenyl)-alpha-(1H-1,2,4-triazol-1-ylmethyl)-
CAS 81886-49-9C13H13ClN6O
2-(4-Fluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol chemical structure, C13H13FN6O, CAS 81886-51-3
2-(4-Fluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol
CAS 81886-51-3C13H13FN6O
Fosfluconazole chemical structure, C13H13F2N6O4P, CAS 194798-83-9
Fosfluconazole
CAS 194798-83-9C13H13F2N6O4P
Fluconazole hydrate chemical structure, C13H14F2N6O2, CAS 155347-36-7
Fluconazole hydrate
CAS 155347-36-7C13H14F2N6O2
4-Amino-1-2-(2,4-difluorophenyl)-2-hydroxy-3(1H-1,2,4-triazol-1-yl)propyl)-4H-1,2,4-triazolium ion chemical structure, C13H14F2N7O+, CAS 749821-19-0
4-Amino-1-2-(2,4-difluorophenyl)-2-hydroxy-3(1H-1,2,4-triazol-1-yl)propyl)-4H-1,2,4-triazolium ion
CAS 749821-19-0C13H14F2N7O+
2-(2,4-Difluorophenyl)-1,3-bis(1,2,4-triazole-1-yl)-2-(trimethylsilyloxy)propane chemical structure, C16H20F2N6OSi, CAS 166173-18-8
2-(2,4-Difluorophenyl)-1,3-bis(1,2,4-triazole-1-yl)-2-(trimethylsilyloxy)propane
CAS 166173-18-8C16H20F2N6OSi
2-Phenyl-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol chemical structure, C13H14N6O, CAS 81886-50-2
2-Phenyl-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol
CAS 81886-50-2C13H14N6O
4-Amino fluconazole bromide chemical structure, C13H14BrF2N7O, CAS 150168-54-0
4-Amino fluconazole bromide
CAS 150168-54-0C13H14BrF2N7O
Fluconazole mesylate chemical structure, C14H16F2N6O4S, CAS 159532-41-9
Fluconazole mesylate
CAS 159532-41-9C14H16F2N6O4S
1-[2-(2,4-Difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)propyl]-1H-1,2,4-triazole chemical structure, C13H12F2N6, CAS 94514-90-6
1-[2-(2,4-Difluorophenyl)-3-(1H-1,2,4-triazol-1-yl)propyl]-1H-1,2,4-triazole
CAS 94514-90-6C13H12F2N6
2-(2,4-Difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)(~2~H_4_)propan-2-ol chemical structure, C13H12F2N6O, CAS 1124197-58-5
2-(2,4-Difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)(~2~H_4_)propan-2-ol
CAS 1124197-58-5C13H12F2N6O
1-[2-(2,4-Difluorophenyl)-2-fluoro-3-(1H-1,2,4-triazol-1-yl)propyl]-1H-1,2,4-triazole chemical structure, C13H11F3N6, CAS 103470-51-5
1-[2-(2,4-Difluorophenyl)-2-fluoro-3-(1H-1,2,4-triazol-1-yl)propyl]-1H-1,2,4-triazole
CAS 103470-51-5C13H11F3N6
2-(2-Fluorophenyl)-1,3-di(1H-1,2,4-triazol-1-yl)propan-2-ol chemical structure, C13H13FN6O, CAS 1348664-75-4
2-(2-Fluorophenyl)-1,3-di(1H-1,2,4-triazol-1-yl)propan-2-ol
CAS 1348664-75-4C13H13FN6O
2-Desfluoro-2-N,N-dimethyl Fluconazole chemical structure, C15H18FN7O, CAS 960243-81-6
2-Desfluoro-2-N,N-dimethyl Fluconazole
CAS 960243-81-6C15H18FN7O
4-[2-Hydroxy-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-yl]phenol chemical structure, C13H14N6O2, CAS 148854-48-2
4-[2-Hydroxy-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-yl]phenol
CAS 148854-48-2C13H14N6O2
2-(2,4-Difluorophenyl)-1,3-di(1H-1,2,4-triazol-1-yl)propan-2-yl hydrogen phosphonate chemical structure, C13H12F2N6O3P+, CAS 1807913-50-3
2-(2,4-Difluorophenyl)-1,3-di(1H-1,2,4-triazol-1-yl)propan-2-yl hydrogen phosphonate
CAS 1807913-50-3C13H12F2N6O3P+
Fluconazole N-oxide chemical structure, C13H12F2N6O2, CAS 1997296-62-4
Fluconazole N-oxide
CAS 1997296-62-4C13H12F2N6O2