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Murcko scaffold

Ring system with 4 rings and 20 atoms

8 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
20
Chemicals
8
With full pages
1
Scaffold SMILES

c1csc(C2=NCC3CNCCN3c3ccccc32)c1

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 c1csc(C2=NCC3CNCCN3c3ccccc32)c1

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 8 of 8 chemicals

Timelotem chemical structure, C17H18FN3S, CAS 96306-34-2
Timelotem
CAS 96306-34-2C17H18FN3S
KC 5944 chemical structure, C17H19N3S, CAS 87566-34-5
KC 5944
CAS 87566-34-5C17H19N3S
N-Desmethyltimelotem chemical structure, C16H16FN3S, CAS 110622-75-8
N-Desmethyltimelotem
CAS 110622-75-8C16H16FN3S
Pyrazino(1,2-a)(1,4)benzodiazepine, 1,2,3,4,4a,5-hexahydro-3-ethyl-7-(2-thienyl)-, hydrochloride, hydrate (2:4:3) chemical structure, C18H23Cl2N3S, CAS 105138-46-3
Pyrazino(1,2-a)(1,4)benzodiazepine, 1,2,3,4,4a,5-hexahydro-3-ethyl-7-(2-thienyl)-, hydrochloride, hydrate (2:4:3)
CAS 105138-46-3C18H23Cl2N3S
Pyrazino(1,2-a)(1,4)benzodiazepine, 1,2,3,4,4a,5-hexahydro-3-(2-propenyl)-7-(2-thienyl)-, dihydrochloride chemical structure, C19H23Cl2N3S, CAS 105138-47-4
Pyrazino(1,2-a)(1,4)benzodiazepine, 1,2,3,4,4a,5-hexahydro-3-(2-propenyl)-7-(2-thienyl)-, dihydrochloride
CAS 105138-47-4C19H23Cl2N3S
Pyrazino(1,2-a)(1,4)benzodiazepine, 1,2,3,4,4a,5-hexahydro-3-(3-methylbutyl)-7-(2-thienyl)-, dihydrochloride chemical structure, C21H29Cl2N3S, CAS 105138-51-0
Pyrazino(1,2-a)(1,4)benzodiazepine, 1,2,3,4,4a,5-hexahydro-3-(3-methylbutyl)-7-(2-thienyl)-, dihydrochloride
CAS 105138-51-0C21H29Cl2N3S
Pyrazino(1,2-a)(1,4)benzodiazepine, 1,2,3,4,4a,5-hexahydro-10-methoxy-3-methyl-7-(2-thienyl)- chemical structure, C18H21N3OS, CAS 87566-80-1
Pyrazino(1,2-a)(1,4)benzodiazepine, 1,2,3,4,4a,5-hexahydro-10-methoxy-3-methyl-7-(2-thienyl)-
CAS 87566-80-1C18H21N3OS
Timelotem dimaleate chemical structure, C25H26FN3O8S, CAS 105566-70-9
Timelotem dimaleate
CAS 105566-70-9C25H26FN3O8S