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Murcko scaffold

Ring system with 3 rings and 16 atoms

10 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
16
Chemicals
10
With full pages
3
Scaffold SMILES

c1ccc(C2=NC(C3NCCS3)CS2)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(C2=NC(C3NCCS3)CS2)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 10 of 10 chemicals

Pyochelin chemical structure, C14H16N2O3S2, CAS 69772-54-9
Pyochelin
CAS 69772-54-9C14H16N2O3S2
Diacetyl agrochelin chemical structure, C27H38N2O6S2, CAS 247115-75-9
Diacetyl agrochelin
CAS 247115-75-9C27H38N2O6S2
Agrochelin chemical structure, C23H34N2O4S2, CAS 247115-74-8
Agrochelin
CAS 247115-74-8C23H34N2O4S2
Watasemycin B chemical structure, C16H20N2O3S2, CAS 433696-17-4
Watasemycin B
CAS 433696-17-4C16H20N2O3S2
Neopyochelin II chemical structure, C14H16N2O3S2, CAS 164104-34-1
Neopyochelin II
CAS 164104-34-1C14H16N2O3S2
Pyochelin II chemical structure, C14H16N2O3S2, CAS 164104-32-9
Pyochelin II
CAS 164104-32-9C14H16N2O3S2
Watasemycin A chemical structure, C16H20N2O3S2, CAS 433696-15-2
Watasemycin A
CAS 433696-15-2C16H20N2O3S2
Thiazostatin B chemical structure, C15H18N2O3S2, CAS 124509-83-7
Thiazostatin B
CAS 124509-83-7C15H18N2O3S2
Thiazostatin A chemical structure, C15H18N2O3S2, CAS 124508-94-7
Thiazostatin A
CAS 124508-94-7C15H18N2O3S2
2-[4,5-Dihydro-2-(2-hydroxyphenyl)-4-thiazolyl]-4-thiazolidinemethanol chemical structure, C13H16N2O2S2, CAS 184763-20-0
2-[4,5-Dihydro-2-(2-hydroxyphenyl)-4-thiazolyl]-4-thiazolidinemethanol
CAS 184763-20-0C13H16N2O2S2